pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.3	AttenGpKa training set	0	-1	CNS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(N)cc2)cc1	CNS(=O)(=O)c1ccc([N-]S(=O)(=O)c2ccc(N)cc2)cc1	mol28780	CNS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(N)cc2)cc1