pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.07	OCHEM	0	-1	COc1ccccc1Oc1cc([N+](=O)[O-])ccc1NS(C)(=O)=O	COc1ccccc1Oc1cc([N+](=O)[O-])ccc1[N-]S(C)(=O)=O	mol32062	COc1ccccc1Oc1cc([N+](=O)[O-])ccc1NS(C)(=O)=O
