smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCc1c(CC)c([P@@](=O)([O-])O)c(CC)c(CC)c1P(=O)([O-])O	ZINC000604940271	553933533	/nfs/dbraw/zinc/93/35/33/553933533.db2.gz	HAPWTLMXWAZEIS-UHFFFAOYSA-N	-2	2	350.288	1.542	40	0		FDABLL
CCc1c(CC)c([P@](=O)([O-])O)c(CC)c(CC)c1P(=O)([O-])O	ZINC000604940271	553933535	/nfs/dbraw/zinc/93/35/35/553933535.db2.gz	HAPWTLMXWAZEIS-UHFFFAOYSA-N	-2	2	350.288	1.542	40	0		FDABLL
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O[P@@](=O)([O-])O)cc1)C(=O)[O-]	ZINC000002509851	518243944	/nfs/dbraw/zinc/24/39/44/518243944.db2.gz	NYDLNSAKSFUOLE-NSHDSACASA-N	-2	2	361.287	1.679	40	0		FDABLL
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O[P@](=O)([O-])O)cc1)C(=O)[O-]	ZINC000002509851	518243948	/nfs/dbraw/zinc/24/39/48/518243948.db2.gz	NYDLNSAKSFUOLE-NSHDSACASA-N	-2	2	361.287	1.679	40	0		FDABLL
CC(C)(C)OC(=O)N[C@H](Cc1ccc(O[P@@](=O)([O-])O)cc1)C(=O)[O-]	ZINC000002509852	518244412	/nfs/dbraw/zinc/24/44/12/518244412.db2.gz	NYDLNSAKSFUOLE-LLVKDONJSA-N	-2	2	361.287	1.679	40	0		FDABLL
CC(C)(C)OC(=O)N[C@H](Cc1ccc(O[P@](=O)([O-])O)cc1)C(=O)[O-]	ZINC000002509852	518244417	/nfs/dbraw/zinc/24/44/17/518244417.db2.gz	NYDLNSAKSFUOLE-LLVKDONJSA-N	-2	2	361.287	1.679	40	0		FDABLL
Nc1cccc(-c2cccc(NC(P(=O)([O-])O)[P@@](=O)([O-])O)c2)c1	ZINC000096282152	525157984	/nfs/dbraw/zinc/15/79/84/525157984.db2.gz	HQIXHAKEHYPYKV-UHFFFAOYSA-N	-2	2	358.227	1.987	40	0		FDABLL
Nc1cccc(-c2cccc(NC(P(=O)([O-])O)[P@](=O)([O-])O)c2)c1	ZINC000096282152	525157999	/nfs/dbraw/zinc/15/79/99/525157999.db2.gz	HQIXHAKEHYPYKV-UHFFFAOYSA-N	-2	2	358.227	1.987	40	0		FDABLL
O=C([O-])/C=C/c1cccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2O)c1	ZINC000005392758	518343605	/nfs/dbraw/zinc/34/36/05/518343605.db2.gz	ZIVGLUKDHKOQPA-QPJJXVBHSA-N	-2	2	363.347	1.989	40	0		FDABLL