pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.2	AttenGpKa training set	0	-1	CC1(C)C(=O)C=C(O)C=C1O	CC1(C)C(=O)C=C(O)C=C1[O-],CC1(C)C(=O)C=C([O-])C=C1O	mol31167	CC1(C)C(=O)C=C(O)C=C1O
9.73	AttenGpKa training set	-1	-2	CC1(C)C(=O)C=C(O)C=C1[O-],CC1(C)C(=O)C=C([O-])C=C1O	CC1(C)C(=O)C=C([O-])C=C1[O-]	mol31167	CC1(C)C(=O)C=C(O)C=C1O