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)c1oc2cc(-c3cccc([N+](=O)[O-])c3)cc([O-])c2c1C	ZINC000028380967	212616915	/nfs/dbraw/zinc/61/69/15/212616915.db2.gz	NNQNMLSESZJLOK-UHFFFAOYSA-N	-1	1	341.319	4.199	1	5		EIBFMM
O=C1[N-]C(=O)c2c1c1c3ccccc3[nH]c1c1oc3ccccc3c12	ZINC000040822497	213389591	/nfs/dbraw/zinc/38/95/91/213389591.db2.gz	LJKKZFJQIHKQPL-UHFFFAOYSA-N	-1	1	326.311	4.104	1	5		EIBFMM
O=[N+]([O-])c1cc2[nH]c(-c3ccc(Br)cc3)cc2c([O-])c1	ZINC000072113155	216011627	/nfs/dbraw/zinc/01/16/27/216011627.db2.gz	WAQYCHXCHAJIKW-UHFFFAOYSA-N	-1	1	333.141	4.211	1	5		EIBFMM