pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.05000019073486	QSARToolbox	0	-1	CC1(C)[C@@H]2CC[C@@](C(=O)O)(C2)[C@@H]1O	CC1(C)[C@@H]2CC[C@@](C(=O)[O-])(C2)[C@@H]1O	mol34927	CC1(C)[C@@H]2CC[C@@](C(=O)O)(C2)[C@@H]1O