Molecule ID: mol23964

SMILES: CCOc1cc([N+](=O)[O-])c(N)c([N+](=O)[O-])c1

InChI: InChI=1S/C8H9N3O5/c1-2-16-5-3-6(10(12)13)8(9)7(4-5)11(14)15/h3-4H,2,9H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-3.79 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization