pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.87	AttenGpKa training set	1	0	[NH3+]CCc1ccc(C(=O)O)cc1	[NH3+]CCc1ccc(C(=O)[O-])cc1	mol22707	NCCc1ccc(C(=O)O)cc1