pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.7	AttenGpKa training set	0	-1	Fc1cc2nc[nH]c2c(F)c1F	Fc1cc2nc[n-]c2c(F)c1F	mol26440	Fc1cc2nc[nH]c2c(F)c1F
3.1	AttenGpKa training set	1	0	Fc1cc2[nH+]c[nH]c2c(F)c1F	Fc1cc2nc[nH]c2c(F)c1F	mol26440	Fc1cc2nc[nH]c2c(F)c1F
