pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
12.6499996185303	QSARToolbox	0	-1	Cc1ccc(C(=O)Nc2ccccc2S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2)cc1	Cc1ccc(C(=O)[N-]c2ccccc2S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2)cc1	mol35599	Cc1ccc(C(=O)Nc2ccccc2S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2)cc1