pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.016666667	AttenGpKa training set	1	0	CN1CC[NH+]=C(c2ccccc2)c2cc(Cl)ccc21	CN1CCN=C(c2ccccc2)c2cc(Cl)ccc21	mol30305	CN1CCN=C(c2ccccc2)c2cc(Cl)ccc21