pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.87	SAMPL7	0	-1	CS(=O)(=O)NC1(CCc2ccccc2)C[S+]([O-])C1	CS(=O)(=O)[N-]C1(CCc2ccccc2)C[S+]([O-])C1	SM35	CS(=O)(=O)NC1(CCc2ccccc2)C[S+]([O-])C1