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)=CCC/C(C)=C/CC/C(C)=C\CO[P@@](=O)([O-])O[P@@](=O)([O-])O	ZINC000013507238	560217638	/nfs/dbraw/zinc/21/76/38/560217638.db2.gz	VWFJDQUYCIWHTN-PVMFERMNSA-N	-2	1	382.330	4.632	10	0	in-vitro	GJAEML
CC(C)=CCC/C(C)=C/CC/C(C)=C\CO[P@@](=O)([O-])O[P@](=O)([O-])O	ZINC000013507238	560217639	/nfs/dbraw/zinc/21/76/39/560217639.db2.gz	VWFJDQUYCIWHTN-PVMFERMNSA-N	-2	1	382.330	4.632	10	0	in-vitro	GJAEML
CC(C)CCC[C@H](C)CCC[C@@H](C)CCO[P@](=O)([O-])OP(=O)([O-])[O-]	ZINC000031977015	207389165	/nfs/dbraw/zinc/38/91/65/207389165.db2.gz	QLJFEPYMTKDKMH-LSDHHAIUSA-N	-3	1	388.378	4.872	10	0	in-vitro	GJAEML
CC(C)CCC[C@H](C)CCC[C@@H](C)CCO[P@@](=O)([O-])OP(=O)([O-])O	ZINC000031977015	207389169	/nfs/dbraw/zinc/38/91/69/207389169.db2.gz	QLJFEPYMTKDKMH-LSDHHAIUSA-N	-2	1	388.378	4.872	10	0	in-vitro	GJAEML
CC(C)CCC[C@H](C)CCC[C@@H](C)CCO[P@](=O)([O-])OP(=O)([O-])O	ZINC000031977015	207389175	/nfs/dbraw/zinc/38/91/75/207389175.db2.gz	QLJFEPYMTKDKMH-LSDHHAIUSA-N	-2	1	388.378	4.872	10	0	in-vitro	GJAEML
CC(C)CCC[C@H](C)CCC[C@@H](C)CCOP(=O)([O-])O[P@@](=O)([O-])O	ZINC000031977015	207389181	/nfs/dbraw/zinc/38/91/81/207389181.db2.gz	QLJFEPYMTKDKMH-LSDHHAIUSA-N	-2	1	388.378	4.872	10	0	in-vitro	GJAEML
CC(C)CCC[C@H](C)CCC[C@@H](C)CCOP(=O)([O-])O[P@](=O)([O-])O	ZINC000031977015	207389184	/nfs/dbraw/zinc/38/91/84/207389184.db2.gz	QLJFEPYMTKDKMH-LSDHHAIUSA-N	-2	1	388.378	4.872	10	0	in-vitro	GJAEML
CC(C)=CCC/C(C)=C\CC/C(C)=C\CO[P@](=O)([O-])O[P@@](=O)([O-])O	ZINC000013507236	560217619	/nfs/dbraw/zinc/21/76/19/560217619.db2.gz	VWFJDQUYCIWHTN-FBXUGWQNSA-N	-2	1	382.330	4.632	10	0	in-vitro	GJAEML
CC(C)=CCC/C(C)=C\CC/C(C)=C\CO[P@](=O)([O-])O[P@](=O)([O-])O	ZINC000013507236	560217620	/nfs/dbraw/zinc/21/76/20/560217620.db2.gz	VWFJDQUYCIWHTN-FBXUGWQNSA-N	-2	1	382.330	4.632	10	0	in-vitro	GJAEML