Molecule ID: mol35955

SMILES: O=[N+]([O-])c1ccc(/N=N/C(O)=NNc2ccc([N+](=O)[O-])cc2)cc1

InChI: InChI=1S/C13H10N6O5/c20-13(16-14-9-1-5-11(6-2-9)18(21)22)17-15-10-3-7-12(8-4-10)19(23)24/h1-8,14H,(H,16,20)/b17-15+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.70 QSARToolbox 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization