smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@]1(c2ccc(CNCc3cn(Cc4ccccc4)nc3-c3ccc(Cl)cc3)cc2)NC(=O)NC1=O	ZINC000520218541	1066465026	/nfs/dbraw/zinc/46/50/26/1066465026.db2.gz	IXXBEOFPQSOSIX-MUUNZHRXSA-N	0	3	500.002	4.596	20	0		KJADHN
C[C@@]1(c2ccc(CNCc3cn(Cc4ccccc4)nc3-c3ccc(Cl)cc3)cc2)NC(=O)NC1=O	ZINC000520218542	1066465059	/nfs/dbraw/zinc/46/50/59/1066465059.db2.gz	IXXBEOFPQSOSIX-NDEPHWFRSA-N	0	3	500.002	4.596	20	0		KJADHN
C[C@]1(c2ccc(CNCc3cn(Cc4ccccc4Cl)nc3-c3ccccc3)cc2)NC(=O)NC1=O	ZINC000521831887	1066465629	/nfs/dbraw/zinc/46/56/29/1066465629.db2.gz	VPUAXACKJREWDY-MUUNZHRXSA-N	0	3	500.002	4.596	20	0		KJADHN
C[C@@]1(c2ccc(CNCc3cn(Cc4ccccc4Cl)nc3-c3ccccc3)cc2)NC(=O)NC1=O	ZINC000521831888	1066465515	/nfs/dbraw/zinc/46/55/15/1066465515.db2.gz	VPUAXACKJREWDY-NDEPHWFRSA-N	0	3	500.002	4.596	20	0		KJADHN
NC(=O)c1cc2cc(N3CCN(Cc4cn(Cc5ccc(Cl)nc5)c5ccccc45)CC3)ccc2o1	ZINC001139446089	1067164637	/nfs/dbraw/zinc/16/46/37/1067164637.db2.gz	WTDKLRRBWBEGDH-UHFFFAOYSA-N	0	3	500.002	4.905	20	0		KJADHN
Cc1cc2c(ncnc2NCCCC[C@H](N)C(=O)[C@H](OC=O)C2c3ccccc3-c3ccccc32)s1	ZINC001160601159	1067166174	/nfs/dbraw/zinc/16/61/74/1067166174.db2.gz	IINJBYGLRWRONC-JYFHCDHNSA-N	0	3	500.624	4.832	20	0		KJADHN
Cc1cc2c(ncnc2NCCCC[C@H](N)C(=O)[C@@H](OC=O)C2c3ccccc3-c3ccccc32)s1	ZINC001160601160	1067166398	/nfs/dbraw/zinc/16/63/98/1067166398.db2.gz	IINJBYGLRWRONC-OZXSUGGESA-N	0	3	500.624	4.832	20	0		KJADHN
Cc1nc2sccc2c(NCCCC[C@H](N)C(=O)[C@H](OC=O)C2c3ccccc3-c3ccccc32)n1	ZINC001160601388	1067166253	/nfs/dbraw/zinc/16/62/53/1067166253.db2.gz	OCWPKEHFJUGUKY-JYFHCDHNSA-N	0	3	500.624	4.832	20	0		KJADHN
Cc1nc2sccc2c(NCCCC[C@H](N)C(=O)[C@@H](OC=O)C2c3ccccc3-c3ccccc32)n1	ZINC001160601389	1067166425	/nfs/dbraw/zinc/16/64/25/1067166425.db2.gz	OCWPKEHFJUGUKY-OZXSUGGESA-N	0	3	500.624	4.832	20	0		KJADHN
CC(C)(C)OC(=O)CN1CCC(N[C@@]2(O)C=Cc3ccccc3[C@@H]2c2c(O)ccc3ccccc32)CC1	ZINC001172892888	1066510364	/nfs/dbraw/zinc/51/03/64/1066510364.db2.gz	UXLLRMBMMXPFES-BVRKHOPBSA-N	0	3	500.639	4.788	20	0		KJADHN
CC(C)(C)OC(=O)CN1CCC(N[C@@]2(O)C=Cc3ccccc3[C@H]2c2c(O)ccc3ccccc32)CC1	ZINC001172892895	1066510427	/nfs/dbraw/zinc/51/04/27/1066510427.db2.gz	UXLLRMBMMXPFES-IGYGKHONSA-N	0	3	500.639	4.788	20	0		KJADHN
CC(C)(C)OC(=O)CN1CCC(N[C@]2(O)C=Cc3ccccc3[C@H]2c2c(O)ccc3ccccc32)CC1	ZINC001172892899	1066510593	/nfs/dbraw/zinc/51/05/93/1066510593.db2.gz	UXLLRMBMMXPFES-SMCANUKXSA-N	0	3	500.639	4.788	20	0		KJADHN
CC(C)(C)OC(=O)CN1CCC(N[C@]2(O)C=Cc3ccccc3[C@@H]2c2c(O)ccc3ccccc32)CC1	ZINC001172892901	1066510412	/nfs/dbraw/zinc/51/04/12/1066510412.db2.gz	UXLLRMBMMXPFES-VEEOACQBSA-N	0	3	500.639	4.788	20	0		KJADHN
C[C@H](C(=O)N(Cc1ncn2c1CNCCC2)c1ncccn1)c1ccc2c(c1)[nH]c1ccc(Cl)cc12	ZINC001182883885	1066511095	/nfs/dbraw/zinc/51/10/95/1066511095.db2.gz	MCHMBUZSMQZNAW-KRWDZBQOSA-N	0	3	500.006	4.791	20	0		KJADHN
C[C@@H](C(=O)N(Cc1ncn2c1CNCCC2)c1ncccn1)c1ccc2c(c1)[nH]c1ccc(Cl)cc12	ZINC001182883886	1066511145	/nfs/dbraw/zinc/51/11/45/1066511145.db2.gz	MCHMBUZSMQZNAW-QGZVFWFLSA-N	0	3	500.006	4.791	20	0		KJADHN