smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=P([O-])(OCC(O)CO[P@@](=O)([O-])OC[C@H](O)CO)OC[C@H](O)CO	ZINC000004096229	560193969	/nfs/dbraw/zinc/19/39/69/560193969.db2.gz	RCBRFGAYXGRKBS-HTQZYQBOSA-N	-2	1	400.210	-2.679	10	0	in-vitro	HAAEML
O=c1[nH]cnc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO[P@@](=O)([O-])O[P@](=O)([O-])O)O1	ZINC000008217123	571691800	/nfs/dbraw/zinc/69/18/00/571691800.db2.gz	BKUSIKGSPSFQAC-RRKCRQDMSA-N	-2	1	412.188	-1.006	10	0	endogenous,in-man	HAAEML
O=c1[nH]cnc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])O)O1	ZINC000008217123	571691797	/nfs/dbraw/zinc/69/17/97/571691797.db2.gz	BKUSIKGSPSFQAC-RRKCRQDMSA-N	-2	1	412.188	-1.006	10	0	endogenous,in-man	HAAEML
Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO[P@@](=O)([O-])O[P@](=O)([O-])O)O2)cc1CO	ZINC000008234366	560207896	/nfs/dbraw/zinc/20/78/96/560207896.db2.gz	RQKDPSTWKKMBPM-XLPZGREQSA-N	-2	1	417.204	-1.808	10	0	in-vitro	HAAEML
Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])O)O2)cc1CO	ZINC000008234366	560207895	/nfs/dbraw/zinc/20/78/95/560207895.db2.gz	RQKDPSTWKKMBPM-XLPZGREQSA-N	-2	1	417.204	-1.808	10	0	in-vitro	HAAEML
Cc1cn([C@H]2C[C@@H](O)[C@@H](CO[P@@](=O)([O-])O[P@](=O)([O-])O)O2)c(=O)[nH]c1=O	ZINC000012503051	560212484	/nfs/dbraw/zinc/21/24/84/560212484.db2.gz	UJLXYODCHAELLY-BWZBUEFSSA-N	-2	1	402.189	-1.280	10	0	in-vitro	HAAEML
Cc1cn([C@H]2C[C@@H](O)[C@@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])O)O2)c(=O)[nH]c1=O	ZINC000012503051	560212479	/nfs/dbraw/zinc/21/24/79/560212479.db2.gz	UJLXYODCHAELLY-BWZBUEFSSA-N	-2	1	402.189	-1.280	10	0	in-vitro	HAAEML
NC(=O)c1ncn([C@@H]2O[C@H](CO[P@](=O)([O-])O[P@](=O)([O-])O)[C@@H](O)[C@H]2O)n1	ZINC000031394574	558750273	/nfs/dbraw/zinc/75/02/73/558750273.db2.gz	HWSPXPQHONXITJ-AFCXAGJDSA-N	-2	1	404.165	-2.778	10	0	in-vitro	HAAEML
NC(=O)c1ncn([C@@H]2O[C@H](CO[P@](=O)([O-])O[P@@](=O)([O-])O)[C@@H](O)[C@H]2O)n1	ZINC000031394574	558750270	/nfs/dbraw/zinc/75/02/70/558750270.db2.gz	HWSPXPQHONXITJ-AFCXAGJDSA-N	-2	1	404.165	-2.778	10	0	in-vitro	HAAEML
Nc1ncn([C@@H]2O[C@H](CO[P@@](=O)([O-])O[P@](=O)([O-])O)[C@H](O)[C@H]2O)c(=O)n1	ZINC000077271877	569391288	/nfs/dbraw/zinc/39/12/88/569391288.db2.gz	RQKDGRDHJHINET-JGWLITMVSA-N	-2	1	404.165	-2.934	10	0	in-vitro	HAAEML
Nc1ncn([C@@H]2O[C@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])O)[C@H](O)[C@H]2O)c(=O)n1	ZINC000077271877	569391287	/nfs/dbraw/zinc/39/12/87/569391287.db2.gz	RQKDGRDHJHINET-JGWLITMVSA-N	-2	1	404.165	-2.934	10	0	in-vitro	HAAEML
Nc1ncn([C@@H]2O[C@H](CO[P@@](=O)([O-])O[P@](=O)([O-])O)[C@H](O)[C@@H]2O)c(=O)n1	ZINC000077271879	569391260	/nfs/dbraw/zinc/39/12/60/569391260.db2.gz	RQKDGRDHJHINET-DPYQTVNSSA-N	-2	1	404.165	-2.934	10	0	in-vitro	HAAEML
Nc1ncn([C@@H]2O[C@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])O)[C@H](O)[C@@H]2O)c(=O)n1	ZINC000077271879	569391259	/nfs/dbraw/zinc/39/12/59/569391259.db2.gz	RQKDGRDHJHINET-DPYQTVNSSA-N	-2	1	404.165	-2.934	10	0	in-vitro	HAAEML
Nc1ccn([C@@H]2O[C@H](CO[P@@](=O)([O-])O[P@](=O)([O-])O)[C@H](O)C2(F)F)c(=O)n1	ZINC000077293029	569391320	/nfs/dbraw/zinc/39/13/20/569391320.db2.gz	FRQISCZGNNXEMD-PRMYIZFSSA-N	-2	1	423.158	-1.055	10	0	in-vitro	HAAEML
Nc1ccn([C@@H]2O[C@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])O)[C@H](O)C2(F)F)c(=O)n1	ZINC000077293029	569391319	/nfs/dbraw/zinc/39/13/19/569391319.db2.gz	FRQISCZGNNXEMD-PRMYIZFSSA-N	-2	1	423.158	-1.055	10	0	in-vitro	HAAEML
O=C([O-])N1CCN(C(=O)[O-])CC[NH+]([C@H](CO)[C@@H](O)CO)CCN(C(=O)[O-])CC1	ZINC000261506745	569414109	/nfs/dbraw/zinc/41/41/09/569414109.db2.gz	APKUUESNVQSQDY-NEPJUHHUSA-N	-2	1	408.408	-2.044	10	0		HAAEML
O=C([O-])N1CCN(C(=O)[O-])CC[NH+]([C@@H](CO)[C@H](O)CO)CCN(C(=O)[O-])CC1	ZINC000261506746	569414123	/nfs/dbraw/zinc/41/41/23/569414123.db2.gz	APKUUESNVQSQDY-NWDGAFQWSA-N	-2	1	408.408	-2.044	10	0		HAAEML
O=C([O-])N1CCN(C(=O)[O-])CC[NH+]([C@@H](CO)[C@@H](O)CO)CCN(C(=O)[O-])CC1	ZINC000261506747	569414119	/nfs/dbraw/zinc/41/41/19/569414119.db2.gz	APKUUESNVQSQDY-RYUDHWBXSA-N	-2	1	408.408	-2.044	10	0		HAAEML