pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.67	AttenGpKa training set	0	-1	COc1cc(C(=O)O)cc(C(=O)O)c1	COc1cc(C(=O)[O-])cc(C(=O)O)c1	mol22843	COc1cc(C(=O)O)cc(C(=O)O)c1
3.46	AttenGpKa training set	-1	-2	COc1cc(C(=O)[O-])cc(C(=O)O)c1	COc1cc(C(=O)[O-])cc(C(=O)[O-])c1	mol22843	COc1cc(C(=O)O)cc(C(=O)O)c1