pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.6	AttenGpKa training set	0	-1	NNS(=O)(=O)c1ccccc1	N[N-]S(=O)(=O)c1ccccc1	mol24784	NNS(=O)(=O)c1ccccc1
1.44	AttenGpKa training set	1	0	[NH3+]NS(=O)(=O)c1ccccc1,N[NH2+]S(=O)(=O)c1ccccc1	NNS(=O)(=O)c1ccccc1	mol24784	NNS(=O)(=O)c1ccccc1