smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1[N-]C(=O)N(c2ccc3c(c2)OCO3)C(=O)C1=Cc1c(=O)[nH]c(=S)n(-c2ccc(Cl)cc2)c1O	ZINC000103845569	571363203	/nfs/dbraw/zinc/36/32/03/571363203.db2.gz	PUNFBHNHMVRISQ-MAUPQMMJSA-N	-1	2	512.887	1.642	40	10		KDCBLM
O=C1[N-]C(=O)N(c2ccc3c(c2)OCO3)C(=O)C1=Cc1c(=O)[nH]c(=S)n(-c2ccc(Cl)cc2)c1O	ZINC000103845574	571363286	/nfs/dbraw/zinc/36/32/86/571363286.db2.gz	PUNFBHNHMVRISQ-CZAWJFPGSA-N	-1	2	512.887	1.642	40	10		KDCBLM
NS(=O)(=O)c1cc(S(N)(=O)=O)c(NS(=O)(=O)c2cc(Cl)cc(Cl)c2[O-])cc1Cl	ZINC000104845542	571386855	/nfs/dbraw/zinc/38/68/55/571386855.db2.gz	ZTTQCGSMJTWKOD-UHFFFAOYSA-N	-1	2	510.786	1.448	40	10		KDCBLM
CCc1ccccc1N1C(=O)NC(=O)C(=CNc2ccc(S(=O)(=O)[N-]c3nccnc3OC)cc2)C1=O	ZINC000408526843	572158842	/nfs/dbraw/zinc/15/88/42/572158842.db2.gz	CNFHUDXFLGJICF-NBVRZTHBSA-N	-1	2	522.543	2.427	40	10		KDCBLM
COc1cc(NS(=O)(=O)c2ccc(NC=C3C(=O)[N-]C(=O)N(c4ccccc4OC)C3=O)cc2)nc(OC)n1	ZINC000408532933	572181670	/nfs/dbraw/zinc/18/16/70/572181670.db2.gz	NDPKRLLUYXLDHF-DTQAZKPQSA-N	-1	2	554.541	1.882	40	10		KDCBLM