smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1ccc(C(=O)NC(=Cc2cccc([N+](=O)[O-])c2)c2nc3c([n-]2)[n-]c(=S)[nH]c3=O)cc1	ZINC000017190705	563021535	/nfs/dbraw/zinc/02/15/35/563021535.db2.gz	KGOUFUXEYDIKOB-ZROIWOOFSA-N	-2	3	449.452	3.140	1	5		IGBFHL
COc1c([O-])cc2oc3cc(O)c(CC=C(C)C)c(=O)c-3c([O-])c2c1C[C@@H](O)C(C)(C)O	ZINC000014727636	291357221	/nfs/dbraw/zinc/35/72/21/291357221.db2.gz	GRTNCNHXAJFUAQ-GOSISDBHSA-N	-2	3	444.480	3.255	1	5	biogenic,in-vitro	IGBFHL
COc1c([O-])cc2oc3cc([O-])c(CC=C(C)C)c(O)c3c(=O)c2c1C[C@@H](O)C(C)(C)O	ZINC000014727636	291357222	/nfs/dbraw/zinc/35/72/22/291357222.db2.gz	GRTNCNHXAJFUAQ-GOSISDBHSA-N	-2	3	444.480	3.255	1	5	biogenic,in-vitro	IGBFHL
COc1c([O-])cc2oc3cc4c(c(=O)c-3c([O-])c2c1CC=C(C)C)[C@@H](O)[C@@H](C(C)(C)O)O4	ZINC000014586284	291357440	/nfs/dbraw/zinc/35/74/40/291357440.db2.gz	INYICHQLUHYLEX-GGAORHGYSA-N	-2	3	442.464	3.440	1	5	biogenic,in-vitro	IGBFHL
Cc1ccc2c(ccc(C(=O)Nc3ccc4c([O-])c(C(=O)[O-])cc([N+](=O)[O-])c4n3)c2[O-])n1	ZINC000040394521	563100431	/nfs/dbraw/zinc/10/04/31/563100431.db2.gz	YOUQSFVDRFZVNU-UHFFFAOYSA-N	-3	3	434.364	3.361	1	5		IGBFHL