smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOc1cccc(C[N@@H+]2C[C@H](NC(=O)c3cccc(-c4ccc(F)cc4)c3)C[C@H]2C(=O)OC)c1O	ZINC000014885657	521346179	/nfs/dbraw/zinc/34/61/79/521346179.db2.gz	NVBKCXFCUOJRTN-RPWUZVMVSA-N	1	2	492.547	4.143	10	10		JICELO
CCOc1cccc(C[N@H+]2C[C@H](NC(=O)c3cccc(-c4ccc(F)cc4)c3)C[C@H]2C(=O)OC)c1O	ZINC000014885657	521346185	/nfs/dbraw/zinc/34/61/85/521346185.db2.gz	NVBKCXFCUOJRTN-RPWUZVMVSA-N	1	2	492.547	4.143	10	10		JICELO
CC(=O)N(c1ccc(Nc2c3ccccc3[nH+]c3cc([N+](=O)[O-])ccc32)cc1)S(C)(=O)=O	ZINC000026840988	563036821	/nfs/dbraw/zinc/03/68/21/563036821.db2.gz	HXETVTOHTZTQSP-UHFFFAOYSA-N	1	2	450.476	4.352	10	10		JICELO