Molecule ID: mol31454

SMILES: CN(O)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1

InChI: InChI=1S/C8H7ClN2O4/c1-10(13)8(12)5-2-3-6(9)7(4-5)11(14)15/h2-4,13H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization