smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1ccc([O-])c(C(=O)/C=C/c2ccc(O)c(Cl)c2)c1	ZINC000757475140	621715894	/nfs/dbraw/zinc/71/58/94/621715894.db2.gz	XYCATDVSHSVPGZ-DAFODLJHSA-N	-2	2	318.712	3.346	20	30		DGEDLL
C[C@@H](CC#N)[N@H+](C)Cc1c(O)ccc(C(=O)c2ccccc2)c1[O-]	ZINC000728902417	575193155	/nfs/dbraw/zinc/19/31/55/575193155.db2.gz	PBDJUGMIGBBSME-ZDUSSCGKSA-N	-2	2	324.380	3.063	20	30		DGEDLL
O=C([O-])c1ccc([O-])c(C(=O)/C=C\c2ccc(O)c(Cl)c2)c1	ZINC000757475141	621716230	/nfs/dbraw/zinc/71/62/30/621716230.db2.gz	XYCATDVSHSVPGZ-RJRFIUFISA-N	-2	2	318.712	3.346	20	30		DGEDLL
C[C@H](CC#N)[N@H+](C)Cc1c(O)ccc(C(=O)c2ccccc2)c1[O-]	ZINC000728902415	575193290	/nfs/dbraw/zinc/19/32/90/575193290.db2.gz	PBDJUGMIGBBSME-CYBMUJFWSA-N	-2	2	324.380	3.063	20	30		DGEDLL