pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.33	AttenGpKa training set	-1	-2	Cc1ccc([C@@H](c2ccc(O)cc2)c2ccccc2C(=O)[O-])cc1	Cc1ccc([C@@H](c2ccc([O-])cc2)c2ccccc2C(=O)[O-])cc1	mol29853	Cc1ccc(C(c2ccc(O)cc2)c2ccccc2C(=O)O)cc1