pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.36	Organic Oxygen Acids and Nitrogen Bases	0	-1	COc1ccc(C(=O)O)cc1OC	COc1ccc(C(=O)[O-])cc1OC	mol10894	COc1ccc(C(=O)O)cc1OC
4.3600001335144	QSARToolbox	0	-1	COc1ccc(C(=O)O)cc1OC	COc1ccc(C(=O)[O-])cc1OC	mol10894	COc1ccc(C(=O)O)cc1OC
4.405	AttenGpKa training set	0	-1	COc1ccc(C(=O)O)cc1OC	COc1ccc(C(=O)[O-])cc1OC	mol10894	COc1ccc(C(=O)O)cc1OC