pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.09	AttenGpKa training set	-1	-2	COc1cc2c(c(O)c1OC)C(=O)c1cc([O-])ccc1C2,COc1cc2c(c([O-])c1OC)C(=O)c1cc(O)ccc1C2	COc1cc2c(c([O-])c1OC)C(=O)c1cc([O-])ccc1C2	mol29772	COc1cc2c(c(O)c1OC)C(=O)c1cc(O)ccc1C2
