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(Nc1ccccc1[N+](=O)[O-])C1CC(=O)Nc2nc(N3CCOCC3)[n-]c(=O)c21	ZINC000019961070	568586171	/nfs/dbraw/zinc/58/61/71/568586171.db2.gz	NNNIQINAYFXLTB-SNVBAGLBSA-N	-1	3	414.378	0.579	40	5		HCBBHM
O=C(Nc1ccccc1[N+](=O)[O-])C1CC(=O)Nc2nc(N3CCOCC3)[n-]c(=O)c21	ZINC000019961074	568586094	/nfs/dbraw/zinc/58/60/94/568586094.db2.gz	NNNIQINAYFXLTB-JTQLQIEISA-N	-1	3	414.378	0.579	40	5		HCBBHM
O=C(Nc1cccc([N+](=O)[O-])c1)C1CC(=O)Nc2nc(N3CCOCC3)[n-]c(=O)c21	ZINC000020800122	527375284	/nfs/dbraw/zinc/37/52/84/527375284.db2.gz	NQLQBSRDLCQHGA-GFCCVEGCSA-N	-1	3	414.378	0.579	40	5		HCBBHM
O=C(Nc1cccc([N+](=O)[O-])c1)C1CC(=O)Nc2nc(N3CCOCC3)[n-]c(=O)c21	ZINC000020800126	527375626	/nfs/dbraw/zinc/37/56/26/527375626.db2.gz	NQLQBSRDLCQHGA-LBPRGKRZSA-N	-1	3	414.378	0.579	40	5		HCBBHM
O=C(Nc1ccc([N+](=O)[O-])cc1)C1CC(=O)Nc2nc(N3CCOCC3)[n-]c(=O)c21	ZINC000020800130	527260363	/nfs/dbraw/zinc/26/03/63/527260363.db2.gz	XSCKYBMGDZSLIW-GFCCVEGCSA-N	-1	3	414.378	0.579	40	5		HCBBHM
O=C(Nc1ccc([N+](=O)[O-])cc1)C1CC(=O)Nc2nc(N3CCOCC3)[n-]c(=O)c21	ZINC000020800134	527261641	/nfs/dbraw/zinc/26/16/41/527261641.db2.gz	XSCKYBMGDZSLIW-LBPRGKRZSA-N	-1	3	414.378	0.579	40	5		HCBBHM