Molecule ID: mol36037

SMILES: CCP(=O)(CC)C(C=O)=NNc1ccc([N+](=O)[O-])cc1

InChI: InChI=1S/C12H16N3O4P/c1-3-20(19,4-2)12(9-16)14-13-10-5-7-11(8-6-10)15(17)18/h5-9,13H,3-4H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization