smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncccc1S(=O)(=O)[N-]c1cccc(F)c1	ZINC001164706095	719873159	/nfs/dbraw/zinc/87/31/59/719873159.db2.gz	OSOHWOJUEAEOPM-XXBNENTESA-N	0	2	492.573	2.254	20	0		JEADLN
COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncccc1S(=O)(=O)[N-]c1cccc(F)c1	ZINC001164706091	719873371	/nfs/dbraw/zinc/87/33/71/719873371.db2.gz	OSOHWOJUEAEOPM-CVDCTZTESA-N	0	2	492.573	2.254	20	0		JEADLN
COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncccc1S(=O)(=O)[N-]c1cccc(F)c1	ZINC001164706093	719873406	/nfs/dbraw/zinc/87/34/06/719873406.db2.gz	OSOHWOJUEAEOPM-WMZHIEFXSA-N	0	2	492.573	2.254	20	0		JEADLN
COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncccc1S(=O)(=O)[N-]c1cccc(F)c1	ZINC001164706083	719873571	/nfs/dbraw/zinc/87/35/71/719873571.db2.gz	OSOHWOJUEAEOPM-AUSIDOKSSA-N	0	2	492.573	2.254	20	0		JEADLN