pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.53	AttenGpKa training set	0	-1	COc1ccc(O)c(C(=O)c2ccccc2)c1	COc1ccc([O-])c(C(=O)c2ccccc2)c1	mol30717	COc1ccc(O)c(C(=O)c2ccccc2)c1
