pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.39	AttenGpKa training set	0	-1	Cc1ccc([NH2+]C(C)(C)C(=O)[O-])cc1	Cc1ccc(NC(C)(C)C(=O)[O-])cc1	mol23399	Cc1ccc(NC(C)(C)C(=O)O)cc1