pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.17	AttenGpKa training set	0	-1	CC[C@H](Oc1ccccc1)C(=O)O	CC[C@H](Oc1ccccc1)C(=O)[O-]	mol23357	CCC(Oc1ccccc1)C(=O)O