pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.59	AttenGpKa training set	1	0	CCCCCCOc1ccc([NH3+])cc1	CCCCCCOc1ccc(N)cc1	mol23865	CCCCCCOc1ccc(N)cc1