smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)[C@H](NC(=O)C(F)(F)F)[C@H]([N-]C(=O)C(F)(F)F)C(=O)[O-]	ZINC000584608773	439604707	/nfs/dbraw/zinc/60/47/07/439604707.db2.gz	GAELSXVJSWSIQS-WHFBIAKZSA-N	-2	2	338.204	0.821	10	0		ECAELL
O=C([O-])c1ccc(CN(CP(=O)([O-])O)C[P@](=O)([O-])O)cc1	ZINC000090686280	436435651	/nfs/dbraw/zinc/43/56/51/436435651.db2.gz	ZRWLBBANJLHZBG-UHFFFAOYSA-N	-3	2	339.177	0.457	10	0		ECAELL
O=C([O-])c1ccc(CN(CP(=O)([O-])O)C[P@@](=O)([O-])O)cc1	ZINC000090686280	436435663	/nfs/dbraw/zinc/43/56/63/436435663.db2.gz	ZRWLBBANJLHZBG-UHFFFAOYSA-N	-3	2	339.177	0.457	10	0		ECAELL
CC(C)[C@H](NC(=O)C(F)(F)F)[C@@H]([N-]C(=O)C(F)(F)F)C(=O)[O-]	ZINC000584608704	439605036	/nfs/dbraw/zinc/60/50/36/439605036.db2.gz	GAELSXVJSWSIQS-CRCLSJGQSA-N	-2	2	338.204	0.821	10	0		ECAELL
O=P([O-])(O)C(Br)(Br)[P@](=O)([O-])O	ZINC000059479169	436631741	/nfs/dbraw/zinc/63/17/41/436631741.db2.gz	DQVOQQVHRYLBHX-UHFFFAOYSA-N	-2	2	333.793	0.743	10	0		ECAELL
O=P([O-])(O)C(Br)(Br)[P@@](=O)([O-])O	ZINC000059479169	436631745	/nfs/dbraw/zinc/63/17/45/436631745.db2.gz	DQVOQQVHRYLBHX-UHFFFAOYSA-N	-2	2	333.793	0.743	10	0		ECAELL