smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1cc(Cl)c([O-])c(Cl)c1	ZINC000408911626	231129560	/nfs/dbraw/zinc/12/95/60/231129560.db2.gz	AEAOOSLBSCNWSH-NYYWCZLTSA-N	-1	2	395.173	3.505	40	10		GHCBLM
CCCC1=NN(c2ccc(C(=O)[O-])cc2)C(=O)/C1=C/c1cccc([N+](=O)[O-])c1O	ZINC000101549810	209124790	/nfs/dbraw/zinc/12/47/90/209124790.db2.gz	PGSOPJXUVOQBNW-RVDMUPIBSA-N	-1	2	395.371	3.585	40	10		GHCBLM
CCCC1=NN(c2cccc(C(=O)[O-])c2)C(=O)/C1=C/c1cccc([N+](=O)[O-])c1O	ZINC000101550018	209125134	/nfs/dbraw/zinc/12/51/34/209125134.db2.gz	IXSXFYNEGSEYJL-RVDMUPIBSA-N	-1	2	395.371	3.585	40	10		GHCBLM
O=C([O-])C1=CC(=NNc2ccc(S(=O)(=O)Nc3ccccn3)cc2)C=CC1=O	ZINC000100031653	209193454	/nfs/dbraw/zinc/19/34/54/209193454.db2.gz	NCEXYHBECQHGNR-MRCUWXFGSA-N	-1	2	398.400	3.702	40	10		GHCBLM
COc1cc(/C=C2/C(=O)[N-]C(=O)NC2=O)ccc1OCc1c(C)cc(C)cc1C	ZINC000059305951	858284055	/nfs/dbraw/zinc/28/40/55/858284055.db2.gz	UMODXUILVRYJJQ-UHFFFAOYSA-N	-1	2	394.427	3.789	40	10		GHCBLM
COc1cc(/C=C2\C(=O)[N-]C(=O)NC2=O)ccc1OCc1c(C)cc(C)cc1C	ZINC000059305951	858284063	/nfs/dbraw/zinc/28/40/63/858284063.db2.gz	UMODXUILVRYJJQ-UHFFFAOYSA-N	-1	2	394.427	3.789	40	10		GHCBLM
CC1=NN(c2ccc(C)c(Cl)c2)C(=O)C1=CNc1ccc(C(=O)[O-])c(O)c1	ZINC000408534590	528150440	/nfs/dbraw/zinc/15/04/40/528150440.db2.gz	WDNKFIKJELUGFX-DHDCSXOGSA-N	-1	2	385.807	3.771	40	10		GHCBLM
O=C([O-])CCc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)cc1	ZINC000008104350	221027408	/nfs/dbraw/zinc/02/74/08/221027408.db2.gz	KEMGZFOTQJYFCA-UHFFFAOYSA-N	-1	2	388.470	3.628	40	10		GHCBLM
CCCC1=NN(c2cccc(C(=O)[O-])c2)C(=O)/C1=C/c1cc([N+](=O)[O-])ccc1O	ZINC000101550090	570996583	/nfs/dbraw/zinc/99/65/83/570996583.db2.gz	SDAVIJZRXYQRPQ-LFIBNONCSA-N	-1	2	395.371	3.585	40	10		GHCBLM
CC1=NN(c2ccc(C)c(C)c2)C(=O)C1C=Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000005337655	570434349	/nfs/dbraw/zinc/43/43/49/570434349.db2.gz	DBXFRMLKCQOUEO-YBEGLDIGSA-N	-1	2	394.387	3.628	40	10		GHCBLM