pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.3	OCHEM	0	-1	O=S(=O)(c1ccccc1)c1cnccc1NS(=O)(=O)C(F)(F)F	O=S(=O)(c1ccccc1)c1cnccc1[N-]S(=O)(=O)C(F)(F)F	mol18872	O=S(=O)(c1ccccc1)c1cnccc1NS(=O)(=O)C(F)(F)F
1.0	OCHEM	1	0	O=S(=O)(c1ccccc1)c1c[nH+]ccc1NS(=O)(=O)C(F)(F)F,O=S(=O)(c1ccccc1)c1cnccc1[NH2+]S(=O)(=O)C(F)(F)F	O=S(=O)(c1ccccc1)c1cnccc1NS(=O)(=O)C(F)(F)F	mol18872	O=S(=O)(c1ccccc1)c1cnccc1NS(=O)(=O)C(F)(F)F