Molecule ID: mol35787

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

InChI: InChI=1S/C5H6N6O12/c12-6(13)3(7(14)15)1-5(10(20)21,11(22)23)2-4(8(16)17)9(18)19/h3-4H,1-2H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization