pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.9	AttenGpKa training set	-1	-2	Cc1ccc(S(=O)(=O)[N-]c2ccccc2/C=N/Nc2ccccc2)cc1	Cc1ccc(S(=O)(=O)[N-]c2ccccc2/C=N/[N-]c2ccccc2)cc1	mol28808	Cc1ccc(S(=O)(=O)Nc2ccccc2/C=N/Nc2ccccc2)cc1
11.0	AttenGpKa training set	-1	-2	Cc1ccc(S(=O)(=O)[N-]c2ccccc2/C=N/Nc2ccccc2)cc1	Cc1ccc(S(=O)(=O)[N-]c2ccccc2/C=N/[N-]c2ccccc2)cc1	mol28808	Cc1ccc(S(=O)(=O)Nc2ccccc2/C=N/Nc2ccccc2)cc1