smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1nc(-c2ccc([P@@](=O)([O-])O)o2)c(C(=O)OCc2ccccc2)s1	ZINC000066111526	222137681	/nfs/dbraw/zinc/13/76/81/222137681.db2.gz	SSEXBHDKTBGKPE-UHFFFAOYSA-N	-1	2	380.318	2.145	1	0		GEAFLM
Nc1nc(-c2ccc([P@](=O)([O-])O)o2)c(C(=O)OCc2ccccc2)s1	ZINC000066111526	222137684	/nfs/dbraw/zinc/13/76/84/222137684.db2.gz	SSEXBHDKTBGKPE-UHFFFAOYSA-N	-1	2	380.318	2.145	1	0		GEAFLM
Nc1cccc2c1nc(-c1ccc([P@@](=O)([O-])O)o1)n2Cc1cccc(O)c1	ZINC000045335014	205096258	/nfs/dbraw/zinc/09/62/58/205096258.db2.gz	KVMRWXCAEUMEKD-UHFFFAOYSA-N	-1	2	385.316	2.435	1	0		GEAFLM
Nc1cccc2c1nc(-c1ccc([P@](=O)([O-])O)o1)n2Cc1cccc(O)c1	ZINC000045335014	205096262	/nfs/dbraw/zinc/09/62/62/205096262.db2.gz	KVMRWXCAEUMEKD-UHFFFAOYSA-N	-1	2	385.316	2.435	1	0		GEAFLM
O=C([O-])[C@H]1CC[C@@H](n2c(=O)cc(O)n(CCc3cccc(Cl)c3)c2=O)C1	ZINC000101678131	208394988	/nfs/dbraw/zinc/39/49/88/208394988.db2.gz	AIPRKMQHUFVEPR-GXTWGEPZSA-N	-1	2	378.812	2.317	1	0		GEAFLM
O=C([O-])[C@H]1CC[C@@H](n2c(O)cc(=O)n(CCc3cccc(Cl)c3)c2=O)C1	ZINC000101678131	208394994	/nfs/dbraw/zinc/39/49/94/208394994.db2.gz	AIPRKMQHUFVEPR-GXTWGEPZSA-N	-1	2	378.812	2.317	1	0		GEAFLM
COC(=O)c1ccc(-c2sc(N)nc2-c2ccc([P@@](=O)([O-])O)o2)cc1	ZINC000066112055	222137833	/nfs/dbraw/zinc/13/78/33/222137833.db2.gz	ATWWSFMWLREEAU-UHFFFAOYSA-N	-1	2	380.318	2.242	1	0		GEAFLM
COC(=O)c1ccc(-c2sc(N)nc2-c2ccc([P@](=O)([O-])O)o2)cc1	ZINC000066112055	222137836	/nfs/dbraw/zinc/13/78/36/222137836.db2.gz	ATWWSFMWLREEAU-UHFFFAOYSA-N	-1	2	380.318	2.242	1	0		GEAFLM
NC(=O)c1ccc2cc(Br)c(C(F)(F)[P@@](=O)([O-])O)cc2n1	ZINC000029047767	581100565	/nfs/dbraw/zinc/10/05/65/581100565.db2.gz	DTMNLXGNQMRBKO-UHFFFAOYSA-N	-1	2	381.069	2.323	1	0		GEAFLM
NC(=O)c1ccc2cc(Br)c(C(F)(F)[P@](=O)([O-])O)cc2n1	ZINC000029047767	581100566	/nfs/dbraw/zinc/10/05/66/581100566.db2.gz	DTMNLXGNQMRBKO-UHFFFAOYSA-N	-1	2	381.069	2.323	1	0		GEAFLM
COc1ccc(C(=O)c2cc(OC)c(OC)c(OC)c2)cc1O[P@@](=O)([O-])O	ZINC000013779472	221288376	/nfs/dbraw/zinc/28/83/76/221288376.db2.gz	CSHRDCHVKHPXQK-UHFFFAOYSA-N	-1	2	398.304	2.424	1	0		GEAFLM
COc1ccc(C(=O)c2cc(OC)c(OC)c(OC)c2)cc1O[P@](=O)([O-])O	ZINC000013779472	221288378	/nfs/dbraw/zinc/28/83/78/221288378.db2.gz	CSHRDCHVKHPXQK-UHFFFAOYSA-N	-1	2	398.304	2.424	1	0		GEAFLM