Molecule ID: mol25176

SMILES: O=[N+]([O-])c1cccc[n+]1O

InChI: InChI=1S/C5H5N2O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H/q+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-2.71 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization