smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Nc1nc2c(ncn2[C@H]2O[C@H](COC(=O)c3ccc(S(=O)(=O)F)cc3)[C@@H](O)[C@H]2O)c(=O)[nH]1	49771220	MSSYMDIMEWWFAD-CGEWXTDFSA-N	469.407	-1.164	70	1	JAIF	
Nc1nc2c(nc(N)n2[C@@H]2O[C@H](COC(=O)c3ccc(S(=O)(=O)F)cc3)[C@@H](O)[C@H]2O)c(=O)[nH]1	49771372	OVEKQYAMIBXBHS-IDTAVKCVSA-N	484.422	-1.582	70	1	JAIF	
O=C(Nc1c(O)nc(O)nc1NC[C@H](O)[C@H](O)[C@@H](O)CO)c1ccc(S(=O)(=O)F)cc1	2356756728	HGVTWAVCJVRBFK-NHCYSSNCSA-N	462.412	-1.715	70	1	JAIF	
Nc1nc2c(ncn2[C@@H]2O[C@H](COC(=O)c3ccc(S(=O)(=O)F)cc3)[C@@H](O)[C@H]2O)c(=O)[nH]1	49771219	MSSYMDIMEWWFAD-SDBHATRESA-N	469.407	-1.164	70	1	JAIF	
O=C(OC[C@H]1O[C@@H](C2=NN[C@H]3C(=O)N=CN=C23)[C@H](O)[C@@H]1O)c1ccc(S(=O)(=O)F)cc1	169326501	XUXJHIUDMHCBDU-YGARTUKASA-N	454.392	-1.672	70	1	JAIF	
O=C(Nc1c(NC[C@H](O)[C@H](O)[C@H](O)CO)[nH]c(=O)[nH]c1=O)c1ccc(S(=O)(=O)F)cc1	43379913	HGVTWAVCJVRBFK-UMNHJUIQSA-N	462.412	-2.539	70	1	JAIF	biogenic
Nc1nc2c(nc(N)n2[C@H]2O[C@H](COC(=O)c3ccc(S(=O)(=O)F)cc3)[C@@H](O)[C@H]2O)c(=O)[nH]1	49771373	OVEKQYAMIBXBHS-PYUPQCDSSA-N	484.422	-1.582	70	1	JAIF	
O=C(OC[C@H]1O[C@@H](C2=NN[C@@H]3C(=O)N=CN=C23)[C@H](O)[C@@H]1O)c1ccc(S(=O)(=O)F)cc1	169326502	XUXJHIUDMHCBDU-VILKCFAHSA-N	454.392	-1.672	70	1	JAIF	
O=C(Nc1c(O)nc(O)nc1NC[C@H](O)[C@@H](O)[C@@H](O)CO)c1ccc(S(=O)(=O)F)cc1	2356756727	HGVTWAVCJVRBFK-JBLDHEPKSA-N	462.412	-1.715	70	1	JAIF