pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.5	Baltruschat ChEMBL	0	-1	COc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OC)c2c1CC[C@@H](N(C)C)C2	COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(OC)c2c1CC[C@@H](N(C)C)C2	mol19317	COc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OC)c2c1CC[C@@H](N(C)C)C2