smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])CCc1c2cc([N+](=O)[O-])ccc2[nH]c1C(=O)[O-]	ZINC000082149074	177924166	/nfs/dbraw/zinc/92/41/66/177924166.db2.gz	PQHHEHIJRCJZRX-UHFFFAOYSA-N	-2	0	278.220	1.792	1	5		CDBFRL
O=C([O-])CCc1c2ccc([N+](=O)[O-])cc2[nH]c1C(=O)[O-]	ZINC000000013222	169506278	/nfs/dbraw/zinc/50/62/78/169506278.db2.gz	KNNJSTZHQSLHBI-UHFFFAOYSA-N	-2	0	278.220	1.792	1	5		CDBFRL
COc1cc2c(C(=O)[O-])cc(C(=O)[O-])nc2c([N+](=O)[O-])c1	ZINC000026579528	171494202	/nfs/dbraw/zinc/49/42/02/171494202.db2.gz	SMTSEAGFLCHZJR-UHFFFAOYSA-N	-2	0	292.203	1.548	1	5		CDBFRL