smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCc1nc(SC(=Cc2ccc(Sc3ccccc3)c([N+](=O)[O-])c2)C(=O)[O-])n[n-]1	ZINC000408632740	557074005	/nfs/dbraw/zinc/07/40/05/557074005.db2.gz	SBEUMFWEHVMYOJ-SFQUDFHCSA-N	-2	3	442.522	5.034	40	5		IKBBHL
CCCc1nc(SC(=Cc2cc([N+](=O)[O-])ccc2Sc2ccccc2)C(=O)[O-])n[n-]1	ZINC000408632596	557073963	/nfs/dbraw/zinc/07/39/63/557073963.db2.gz	RQCDBEKWQDATNJ-SFQUDFHCSA-N	-2	3	442.522	5.034	40	5		IKBBHL
O=c1nc(C=Cc2cn(Cc3ccc4ccccc4c3)c3ccccc23)c([N+](=O)[O-])c([O-])[n-]1	ZINC000409314483	557106070	/nfs/dbraw/zinc/10/60/70/557106070.db2.gz	RMDBBRUXPAOXFB-VAWYXSNFSA-N	-2	3	438.443	5.123	40	5		IKBBHL