pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.6	AttenGpKa training set	1	0	CC(=O)Nc1ccc(-c2ccc([NH3+])cc2)cc1	CC(=O)Nc1ccc(-c2ccc(N)cc2)cc1	mol23959	CC(=O)Nc1ccc(-c2ccc(N)cc2)cc1