Molecule ID: mol25420

SMILES: COc1nc(C)n(C)c1[N+](=O)[O-]

InChI: InChI=1S/C6H9N3O3/c1-4-7-5(12-3)6(8(4)2)9(10)11/h1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization