smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1nccn1C[C@@H](O)C[N@H+]1[C@@H]2CCCC[C@@H]21	ZINC000008461887	170336734	/nfs/dbraw/zinc/33/67/34/170336734.db2.gz	PYFVVJHOMNLKIO-LCONVBBXSA-N	1	2	266.301	0.779	1	5		CCBFLO
O=[N+]([O-])c1nccn1C[C@@H](O)C[N@@H+]1[C@@H]2CCCC[C@@H]21	ZINC000008461887	170336735	/nfs/dbraw/zinc/33/67/35/170336735.db2.gz	PYFVVJHOMNLKIO-LCONVBBXSA-N	1	2	266.301	0.779	1	5		CCBFLO
O=[N+]([O-])c1nccn1C[C@@H](O)C[N@H+]1[C@@H]2CCC[C@@H]21	ZINC000008461888	170336714	/nfs/dbraw/zinc/33/67/14/170336714.db2.gz	OIDNCWWLMVXHET-OQVKGCGUSA-N	1	2	252.274	0.389	1	5		CCBFLO
O=[N+]([O-])c1nccn1C[C@@H](O)C[N@@H+]1[C@@H]2CCC[C@@H]21	ZINC000008461888	170336716	/nfs/dbraw/zinc/33/67/16/170336716.db2.gz	OIDNCWWLMVXHET-OQVKGCGUSA-N	1	2	252.274	0.389	1	5		CCBFLO
O=c1[nH]c2cc(C[NH+]3CC=CC3)c([N+](=O)[O-])cc2[nH]c1=O	ZINC000027752852	581101778	/nfs/dbraw/zinc/10/17/78/581101778.db2.gz	BQPONRVZKVJARL-UHFFFAOYSA-N	1	2	288.263	0.496	1	5		CCBFLO
O=c1[nH]c2cc([N+](=O)[O-])c(-n3cc[nH+]c3)cc2n(O)c1=O	ZINC000013759242	581101773	/nfs/dbraw/zinc/10/17/73/581101773.db2.gz	NVLCJYYASKEWFF-UHFFFAOYSA-N	1	2	289.207	0.021	1	5		CCBFLO
O=c1[nH]c2cc([N+](=O)[O-])c(-n3cc[nH+]c3)nc2[nH]c1=O	ZINC000013755437	581101793	/nfs/dbraw/zinc/10/17/93/581101793.db2.gz	OCEDPPPKQBHDND-UHFFFAOYSA-N	1	2	274.196	0.118	1	5		CCBFLO