pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
-0.05	AttenGpKa training set	1	0	CN(C)S(=O)(=O)c1ccc2ccccc2[nH+]1,C[NH+](C)S(=O)(=O)c1ccc2ccccc2n1	CN(C)S(=O)(=O)c1ccc2ccccc2n1	mol26122	CN(C)S(=O)(=O)c1ccc2ccccc2n1