Molecule ID: mol25373

SMILES: CCCc1n[nH]c([N+](=O)[O-])n1

InChI: InChI=1S/C5H8N4O2/c1-2-3-4-6-5(8-7-4)9(10)11/h2-3H2,1H3,(H,6,7,8)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization