Molecule ID: mol33607

SMILES: O=[N+]([O-])c1ccc(N=Nc2ccccc2)cc1

InChI: InChI=1S/C12H9N3O2/c16-15(17)12-8-6-11(7-9-12)14-13-10-4-2-1-3-5-10/h1-9H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-3.47 QSARToolbox 2 » 1
-3.47 OCHEM 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization