smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc(CNS(=O)(=O)c2ccc(NC=C3C(=O)[N-]C(=O)NC3=O)cc2)nc(OC)n1	ZINC000016215082	522471928	/nfs/dbraw/zinc/47/19/28/522471928.db2.gz	RUWIGKWCZIBIAN-UHFFFAOYSA-N	-1	0	462.444	-0.366	40	10		JBCBRM
C[C@@H]1CN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2NNC=C2C(=O)[N-]C(=O)NC2=O)C[C@H](C)O1	ZINC000059490017	569606060	/nfs/dbraw/zinc/60/60/60/569606060.db2.gz	SGFDHXHHOULZFB-AOOOYVTPSA-N	-1	0	468.448	-0.441	40	10		JBCBRM
C[C@H]1CN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2NNC=C2C(=O)[N-]C(=O)NC2=O)C[C@H](C)O1	ZINC000059490018	569606017	/nfs/dbraw/zinc/60/60/17/569606017.db2.gz	SGFDHXHHOULZFB-UWVGGRQHSA-N	-1	0	468.448	-0.441	40	10		JBCBRM
C[C@@H]1CN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2NNC=C2C(=O)[N-]C(=O)NC2=O)C[C@@H](C)O1	ZINC000059490019	569606009	/nfs/dbraw/zinc/60/60/09/569606009.db2.gz	SGFDHXHHOULZFB-NXEZZACHSA-N	-1	0	468.448	-0.441	40	10		JBCBRM