Molecule ID: mol25426

SMILES: Cc1n[nH]c([N+](=O)[O-])c1[N+](=O)[O-]

InChI: InChI=1S/C4H4N4O4/c1-2-3(7(9)10)4(6-5-2)8(11)12/h1H3,(H,5,6)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization