Molecule ID: mol11446

SMILES: O=Nc1cc(S(=O)(=O)O)c2cccc(S(=O)(=O)O)c2c1O

InChI: InChI=1S/C10H7NO8S2/c12-10-6(11-13)4-8(21(17,18)19)5-2-1-3-7(9(5)10)20(14,15)16/h1-4,12H,(H,14,15,16)(H,17,18,19)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
6.66 IUPAC digitized pKa -2 » -3
7.32 IUPAC digitized pKa -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization