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(CSc1nc(-c2ccccc2)n[nH]1)Nc1nc2cc([N+](=O)[O-])ccc2s1	ZINC000020530144	568625789	/nfs/dbraw/zinc/62/57/89/568625789.db2.gz	MSMAKCHHVKOUCB-UHFFFAOYSA-N	0	1	412.456	3.720	10	5		HHBEMN
COC1(c2nc(-c3ccccn3)no2)CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000583615850	560776281	/nfs/dbraw/zinc/77/62/81/560776281.db2.gz	DCWUZKWZVNXFOO-OAHLLOKOSA-N	0	1	409.446	3.739	10	5		HHBEMN
COC1(c2nc(-c3ccccn3)no2)CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000583615849	560776341	/nfs/dbraw/zinc/77/63/41/560776341.db2.gz	DCWUZKWZVNXFOO-HNNXBMFYSA-N	0	1	409.446	3.739	10	5		HHBEMN
CC(C)(C)C(=O)Nc1ccc(N2CCCN(Cc3ccc([N+](=O)[O-])cc3)CC2)nc1	ZINC000034681845	568733606	/nfs/dbraw/zinc/73/36/06/568733606.db2.gz	XKHCBARNWMZBCQ-UHFFFAOYSA-N	0	1	411.506	3.687	10	5		HHBEMN