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-])c1cc(-c2ccc(C=Cc3nc([O-])c([N+](=O)[O-])c(=O)[nH]3)o2)ccc1Cl	ZINC000409346708	560713050	/nfs/dbraw/zinc/71/30/50/560713050.db2.gz	NQBPEKUYGKOUHT-UTCJRWHESA-N	-2	1	403.734	3.578	40	5		HHBBML
O=c1[n-]c(C=Cc2ccc(-c3cc([N+](=O)[O-])ccc3Cl)o2)nc([O-])c1[N+](=O)[O-]	ZINC000409333525	560710650	/nfs/dbraw/zinc/71/06/50/560710650.db2.gz	SOPJZUONHNKYRZ-UTCJRWHESA-N	-2	1	404.722	3.788	40	5		HHBBML
O=C([O-])C(=Cc1cc([N+](=O)[O-])ccc1[O-])Sc1nc(-c2ccc(Cl)cc2)n[nH]1	ZINC000408633739	559222601	/nfs/dbraw/zinc/22/26/01/559222601.db2.gz	LWKVYDXBLNHCNS-ZSOIEALJSA-N	-2	1	418.818	3.957	40	5		HHBBML
O=c1[n-]c(C=Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)nc([O-])c1[N+](=O)[O-]	ZINC000409347359	560713136	/nfs/dbraw/zinc/71/31/36/560713136.db2.gz	LXNJHSDRKUYSLE-UTCJRWHESA-N	-2	1	404.722	3.788	40	5		HHBBML
CC(C)COc1ccc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[n-]2)cc1Br	ZINC000408599944	557510263	/nfs/dbraw/zinc/51/02/63/557510263.db2.gz	PFPYODQLRPSAQM-GQCTYLIASA-N	-2	1	410.224	3.764	40	5		HHBBML