pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.39	AttenGpKa training set	1	0	CN1O[C@]2(CC1=O)C[NH+]1CCC2CC1	CN1O[C@]2(CC1=O)CN1CCC2CC1	mol24617	CN1OC2(CC1=O)CN1CCC2CC1