Molecule ID: mol24867

SMILES: CN(C)c1ccc2c(c1)C(O)(OO)N=NC2=O

InChI: InChI=1S/C10H11N3O4/c1-13(2)6-3-4-7-8(5-6)10(15,17-16)12-11-9(7)14/h3-5,15-16H,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.50 QSARToolbox -1 » -2
10.50 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization