pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.92	AttenGpKa training set	0	-1	Fc1c[nH]cn1	Fc1c[n-]cn1	mol25220	Fc1c[nH]cn1
2.44	AttenGpKa training set	1	0	Fc1c[nH]c[nH+]1	Fc1c[nH]cn1	mol25220	Fc1c[nH]cn1