pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.44	Hunt	1	0	CC(C)(C)S[NH2+]c1ccccc1	CC(C)(C)SNc1ccccc1	mol2534	CC(C)(C)SNc1ccccc1