Molecule ID: mol28085

SMILES: CN(C)c1ccc(NC(=N)N[N+](=O)[O-])cc1

InChI: InChI=1S/C9H13N5O2/c1-13(2)8-5-3-7(4-6-8)11-9(10)12-14(15)16/h3-6H,1-2H3,(H3,10,11,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization