smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1[nH][nH]c(=O)c1N=Nc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000012575570	436051573	/nfs/dbraw/zinc/05/15/73/436051573.db2.gz	DDPZEPQYFCYPQW-UHFFFAOYSA-N	0	2	335.389	0.745	10	30		ECEELN
C[C@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1/C(=N/O)c1nonc1N	ZINC000102123072	219187237	/nfs/dbraw/zinc/18/72/37/219187237.db2.gz	OQZVAHOVGVWQFB-UYSITSMJSA-N	0	2	347.335	0.907	10	30		ECEELN
O=C(ON1C(=O)CCC1=O)c1cc2cc(F)c(O)c(F)c2oc1=O	ZINC000087528512	436398539	/nfs/dbraw/zinc/39/85/39/436398539.db2.gz	NZYXABPVYJRICY-UHFFFAOYSA-N	0	2	339.206	0.998	10	30	in-vitro	ECEELN
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1/C(=N/O)c1nonc1N	ZINC000102123067	204031935	/nfs/dbraw/zinc/03/19/35/204031935.db2.gz	OQZVAHOVGVWQFB-LAZURVMCSA-N	0	2	347.335	0.907	10	30		ECEELN