pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.42	AttenGpKa training set	1	0	CC1=CC[NH+]2CC[C@@H](C)[C@H]12	CC1=CCN2CC[C@@H](C)[C@H]12	mol30244	CC1=CCN2CC[C@@H](C)C12