Molecule ID: mol28023

SMILES: C#CCNC(=N)N[N+](=O)[O-]

InChI: InChI=1S/C4H6N4O2/c1-2-3-6-4(5)7-8(9)10/h1H,3H2,(H3,5,6,7)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization