smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=c1[nH]c(=S)ccn1[C@@H]1O[C@H](CO[P@@](=O)([O-])O[P@](=O)([O-])C(F)(F)[P@](=O)([O-])O)[C@@H](O)[C@H]1O	ZINC000071296342	553634890	/nfs/dbraw/zinc/63/48/90/553634890.db2.gz	DFGBPSGNGNHNQM-XVFCMESISA-N	-3	2	534.216	-0.016	10	0	in-vitro	KBAELL
O=c1[nH]c(=S)ccn1[C@@H]1O[C@H](CO[P@@](=O)([O-])O[P@](=O)([O-])C(F)(F)[P@@](=O)([O-])O)[C@@H](O)[C@H]1O	ZINC000071296342	553634887	/nfs/dbraw/zinc/63/48/87/553634887.db2.gz	DFGBPSGNGNHNQM-XVFCMESISA-N	-3	2	534.216	-0.016	10	0	in-vitro	KBAELL
O=c1[nH]c(=S)ccn1[C@H]1O[C@H](CO[P@@](=O)([O-])O[P@](=O)([O-])C(F)(F)[P@](=O)([O-])O)[C@@H](O)[C@H]1O	ZINC000098052580	554176045	/nfs/dbraw/zinc/17/60/45/554176045.db2.gz	DFGBPSGNGNHNQM-JBBNEOJLSA-N	-3	2	534.216	-0.428	10	0	in-vitro	KBAELL
O=c1[nH]c(=S)ccn1[C@H]1O[C@H](CO[P@@](=O)([O-])O[P@](=O)([O-])C(F)(F)[P@@](=O)([O-])O)[C@@H](O)[C@H]1O	ZINC000098052580	554176044	/nfs/dbraw/zinc/17/60/44/554176044.db2.gz	DFGBPSGNGNHNQM-JBBNEOJLSA-N	-3	2	534.216	-0.428	10	0	in-vitro	KBAELL
CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O[P@](=O)([O-])O)cc1)NC(=O)[C@H](CC(=O)[O-])NC(C)=O)C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O	ZINC000169289725	562851759	/nfs/dbraw/zinc/85/17/59/562851759.db2.gz	OAXSBUYJZBCOAD-YUGXLDDKSA-N	-2	2	857.921	-0.449	10	0		KBAELL
CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O[P@@](=O)([O-])O)cc1)NC(=O)[C@H](CC(=O)[O-])NC(C)=O)C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O	ZINC000169289725	562851758	/nfs/dbraw/zinc/85/17/58/562851758.db2.gz	OAXSBUYJZBCOAD-YUGXLDDKSA-N	-2	2	857.921	-0.449	10	0		KBAELL