pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.2	OCHEM	0	-1	CC(C)Cc1ccc(O)cc1	CC(C)Cc1ccc([O-])cc1	mol18554	CC(C)Cc1ccc(O)cc1
10.27	AttenGpKa training set	0	-1	CC(C)Cc1ccc(O)cc1	CC(C)Cc1ccc([O-])cc1	mol18554	CC(C)Cc1ccc(O)cc1