pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.7	AttenGpKa training set	0	-1	CCc1ccc(C(=O)NS(=O)(=O)c2ccc(N)cc2)cc1	CCc1ccc(C(=O)[N-]S(=O)(=O)c2ccc(N)cc2)cc1	mol28659	CCc1ccc(C(=O)NS(=O)(=O)c2ccc(N)cc2)cc1