pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.76	AttenGpKa training set	1	0	C[N+](C)(O)Cc1ccccc1	C[N+](C)([O-])Cc1ccccc1	mol24757	C[N+](C)(O)Cc1ccccc1