pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.2	AttenGpKa training set	2	1	C[NH+](C)Cc1ccccc1C[NH+](C)C	CN(C)Cc1ccccc1C[NH+](C)C	mol24297	CN(C)Cc1ccccc1CN(C)C
