smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CS(=O)(=O)Nc1ccc([O-])c(C(=O)NCCN2CCNC(=O)C2)c1	ZINC000272643783	483014692	/nfs/dbraw/zinc/01/46/92/483014692.db2.gz	DAEYLJCMNNWUDE-UHFFFAOYSA-N	-1	3	356.404	-1.075	20	10		FACDHM
COC(=O)CNC(=O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1[O-]	ZINC000798134986	658579576	/nfs/dbraw/zinc/57/95/76/658579576.db2.gz	XAFRZLGPJDBDAH-UHFFFAOYSA-N	-1	3	359.360	-1.217	20	10		FACDHM
CS(=O)(=O)Nc1ccc([O-])c(C(=O)N2CCN(CC(N)=O)C(=O)C2)c1	ZINC000857535209	658729849	/nfs/dbraw/zinc/72/98/49/658729849.db2.gz	IOPKLKQDPDSNGE-UHFFFAOYSA-N	-1	3	370.387	-1.467	20	10		FACDHM