pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.07	AttenGpKa training set	1	0	CCn1c[nH+]c2ccc(C)cc21	CCn1cnc2ccc(C)cc21	mol26405	CCn1cnc2ccc(C)cc21
