smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)C=c1sc(=Cc2cc(OC)c(OC)cc2[N+](=O)[O-])c(=O)n1CC(=O)N1CCOCC1	ZINC000514297638	1066205181	/nfs/dbraw/zinc/20/51/81/1066205181.db2.gz	QFFAYJGSWNDWLL-UHFFFAOYSA-N	0	0	507.521	-0.134	20	5		KBBDRN
CC(C)(C)NC(=O)CN1CCN(C(=O)CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)CC1	ZINC000514300736	1066205196	/nfs/dbraw/zinc/20/51/96/1066205196.db2.gz	SGQIPXYQRQXQFM-UHFFFAOYSA-N	0	0	510.617	-0.040	20	5		KBBDRN
CN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)N2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c1	ZINC000514386136	1066205901	/nfs/dbraw/zinc/20/59/01/1066205901.db2.gz	FJNBNOYJHQNROZ-UHFFFAOYSA-N	0	0	513.554	-0.460	20	5		KBBDRN