Molecule ID: mol6672

SMILES: Cn1cnc([N+](=O)[O-])c1CC(=O)NN

InChI: InChI=1S/C6H9N5O3/c1-10-3-8-6(11(13)14)4(10)2-5(12)9-7/h3H,2,7H2,1H3,(H,9,12)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-1.01 IUPAC digitized pKa 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization