pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.85	AttenGpKa training set	1	0	C[NH+](CCc1ccccc1)CCc1ccc2ccccc2c1	CN(CCc1ccccc1)CCc1ccc2ccccc2c1	mol24367	CN(CCc1ccccc1)CCc1ccc2ccccc2c1