smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)c1ccc([O-])c([N+](=O)[O-])c1[O-]	91302236	166324147	/nfs/dbraw/zinc/32/41/47/166324147.db2.gz	UIRUEYNZXBZBDK-UHFFFAOYSA-N	-2	0	197.146	1.209	50	5	in-vitro	ADBARL
O=[N+]([O-])c1c([O-])cc(F)cc1[O-]	37594105	171065078	/nfs/dbraw/zinc/06/50/78/171065078.db2.gz	FOOSVTRRNLPPCR-UHFFFAOYSA-N	-2	0	173.099	1.145	50	5		ADBARL
Cc1ccc(C(=O)[O-])c([N+](=O)[O-])c1[O-]	4722153	342994594	/nfs/dbraw/zinc/99/45/94/342994594.db2.gz	HEKGHQKEERXLOI-UHFFFAOYSA-N	-2	0	197.146	1.307	50	5	in-vitro	ADBARL
Cc1cc([O-])c([N+](=O)[O-])cc1C(=O)[O-]	39084407	343197507	/nfs/dbraw/zinc/19/75/07/343197507.db2.gz	LIDKLIGKTGJHFK-UHFFFAOYSA-N	-2	0	197.146	1.307	50	5		ADBARL