Molecule ID: mol30766

SMILES: Cc1cc([N+](=O)[O-])c(C(C)C)c(O)c1[N+](=O)[O-]

InChI: InChI=1S/C10H12N2O5/c1-5(2)8-7(11(14)15)4-6(3)9(10(8)13)12(16)17/h4-5,13H,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization