pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.59	AttenGpKa training set	0	-1	COC(=O)c1ccc(C(=O)O)cc1NC(C)=O	COC(=O)c1ccc(C(=O)[O-])cc1NC(C)=O	mol23030	COC(=O)c1ccc(C(=O)O)cc1NC(C)=O