pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.85	AttenGpKa training set	1	0	C[n+]1c[nH]cc1F	C[n+]1c[n-]cc1F	mol25247	C[n+]1c[nH]cc1F