Molecule ID: mol25475

SMILES: O=[N+]([O-])c1nc(-c2ccccc2)n[nH]1

InChI: InChI=1S/C8H6N4O2/c13-12(14)8-9-7(10-11-8)6-4-2-1-3-5-6/h1-5H,(H,9,10,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization