Molecule ID: mol26467

SMILES: O=[N+]([O-])c1ccc2[nH]cnc2c1O

InChI: InChI=1S/C7H5N3O3/c11-7-5(10(12)13)2-1-4-6(7)9-3-8-4/h1-3,11H,(H,8,9)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization