smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC(=O)[C@H](C[C@@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000064219929	717132534	/nfs/dbraw/zinc/13/25/34/717132534.db2.gz	ZNDDVCUMPVORDL-WPRPVWTQSA-O	0	0	250.746	1.718	40	50		CDGBRN
CC(C)CC(=O)[C@@H](C[C@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000071404761	717132898	/nfs/dbraw/zinc/13/28/98/717132898.db2.gz	FDWKEUUDYNLJTN-MWLCHTKSSA-O	0	0	264.773	1.964	40	50		CDGBRN
CC(C)CC(=O)[C@H](C[C@@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000071404766	717132963	/nfs/dbraw/zinc/13/29/63/717132963.db2.gz	FDWKEUUDYNLJTN-ONGXEEELSA-O	0	0	264.773	1.964	40	50		CDGBRN
CCCC(=O)[C@H](C[C@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000064219924	717132609	/nfs/dbraw/zinc/13/26/09/717132609.db2.gz	ZNDDVCUMPVORDL-WCBMZHEXSA-O	0	0	250.746	1.718	40	50		CDGBRN
CC(C)CC(=O)[C@@H](C[C@@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000071404764	717133222	/nfs/dbraw/zinc/13/32/22/717133222.db2.gz	FDWKEUUDYNLJTN-KOLCDFICSA-O	0	0	264.773	1.964	40	50		CDGBRN
CC(C)C(=O)[C@H](C[C@@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000071404751	717133232	/nfs/dbraw/zinc/13/32/32/717133232.db2.gz	RPCPISLONJWNPZ-IUCAKERBSA-O	0	0	250.746	1.574	40	50		CDGBRN
CC(C)C(=O)[C@@H](C[C@@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000071404750	717133105	/nfs/dbraw/zinc/13/31/05/717133105.db2.gz	RPCPISLONJWNPZ-BDAKNGLRSA-O	0	0	250.746	1.574	40	50		CDGBRN
CCCC(=O)[C@@H](C[C@@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000064219927	717132716	/nfs/dbraw/zinc/13/27/16/717132716.db2.gz	ZNDDVCUMPVORDL-SCZZXKLOSA-O	0	0	250.746	1.718	40	50		CDGBRN
CC(C)C(=O)[C@H](C[C@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000071404747	717132982	/nfs/dbraw/zinc/13/29/82/717132982.db2.gz	RPCPISLONJWNPZ-DTWKUNHWSA-O	0	0	250.746	1.574	40	50		CDGBRN
CC(C)CC(=O)[C@H](C[C@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000071404763	717133223	/nfs/dbraw/zinc/13/32/23/717133223.db2.gz	FDWKEUUDYNLJTN-GXSJLCMTSA-O	0	0	264.773	1.964	40	50		CDGBRN
CCCC(=O)[C@@H](C[C@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000064219923	717132537	/nfs/dbraw/zinc/13/25/37/717132537.db2.gz	ZNDDVCUMPVORDL-PSASIEDQSA-O	0	0	250.746	1.718	40	50		CDGBRN
CC(C)C(=O)[C@@H](C[C@H](Cl)[N+](C)(C)C)C(=O)[O-]	ZINC000071404745	717133215	/nfs/dbraw/zinc/13/32/15/717133215.db2.gz	RPCPISLONJWNPZ-RKDXNWHRSA-O	0	0	250.746	1.574	40	50		CDGBRN