pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.0	OCHEM	1	0	[NH3+]CCCCS(=O)(=O)c1ccccc1	NCCCCS(=O)(=O)c1ccccc1	mol256	NCCCCS(=O)(=O)c1ccccc1