pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
15.5	AttenGpKa training set	0	-1	CC(C)(O)c1ccccc1	CC(C)([O-])c1ccccc1	mol31139	CC(C)(O)c1ccccc1