Molecule ID: mol30824

SMILES: O=[N+]([O-])c1cccc(/N=N/c2ccc(O)cc2O)c1

InChI: InChI=1S/C12H9N3O4/c16-10-4-5-11(12(17)7-10)14-13-8-2-1-3-9(6-8)15(18)19/h1-7,16-17H/b14-13+

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
11.63 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization