pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.0500002	OCHEM	0	-1	O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2	O=C([O-])[C@H]1C[C@H]2CC[C@@H]1C2	mol22277	O=C(O)C1CC2CCC1C2
5.05	AttenGpKa training set	0	-1	O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2	O=C([O-])[C@H]1C[C@H]2CC[C@@H]1C2	mol22277	O=C(O)C1CC2CCC1C2