pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	AttenGpKa training set	0	-1	COc1ccc2c(c1)OC/C(=C\c1ccc(O)c(O)c1)C2=O	COc1ccc2c(c1)OC/C(=C\c1ccc([O-])c(O)c1)C2=O,COc1ccc2c(c1)OC/C(=C\c1ccc(O)c([O-])c1)C2=O	mol30910	COc1ccc2c(c1)OC/C(=C\c1ccc(O)c(O)c1)C2=O
11.2	AttenGpKa training set	-1	-2	COc1ccc2c(c1)OC/C(=C\c1ccc([O-])c(O)c1)C2=O,COc1ccc2c(c1)OC/C(=C\c1ccc(O)c([O-])c1)C2=O	COc1ccc2c(c1)OC/C(=C\c1ccc([O-])c([O-])c1)C2=O	mol30910	COc1ccc2c(c1)OC/C(=C\c1ccc(O)c(O)c1)C2=O