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-])c1ccc([N+](=O)[O-])c([S-])c1	116319021	486926459	/nfs/dbraw/zinc/92/64/59/486926459.db2.gz	AIZFMMQFUASJCC-UHFFFAOYSA-N	-2	0	199.187	1.582	20	5		ADBDRL
O=C([O-])c1cc([S-])ccc1[N+](=O)[O-]	2046780	169356753	/nfs/dbraw/zinc/35/67/53/169356753.db2.gz	GANZODCWZFAEGN-UHFFFAOYSA-N	-2	0	199.187	1.582	20	5	in-vivo	ADBDRL
O=C([O-])c1ccc([N+](=O)[O-])cc1[S-]	69764324	343440400	/nfs/dbraw/zinc/44/04/00/343440400.db2.gz	HABGGBBWFAJWIB-UHFFFAOYSA-N	-2	0	199.187	1.582	20	5		ADBDRL
O=C([O-])c1cccc([N+](=O)[O-])c1[S-]	142930474	344015725	/nfs/dbraw/zinc/01/57/25/344015725.db2.gz	AIGZYDXGPABQPO-UHFFFAOYSA-N	-2	0	199.187	1.582	20	5		ADBDRL