smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@H](NC(=O)C(F)(F)F)[C@@H](O)[C@@H](C)O1	ZINC000028232959	561909378	/nfs/dbraw/zinc/90/93/78/561909378.db2.gz	RQIOYWADAKTIJC-VZBJLAIJSA-N	0	2	639.532	0.721	10	10		KCCELN
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@@H]1C[C@H](NC(=O)C(F)(F)F)[C@H](O)[C@H](C)O1	ZINC000077319793	553665075	/nfs/dbraw/zinc/66/50/75/553665075.db2.gz	RQIOYWADAKTIJC-BRHGRERGSA-N	0	2	639.532	0.721	10	10	in-vitro	KCCELN