pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.22	AttenGpKa training set	1	0	CC(C)(C)c1[nH]c2ccccc2[nH+]1	CC(C)(C)c1nc2ccccc2[nH]1	mol26446	CC(C)(C)c1nc2ccccc2[nH]1