Molecule ID: mol38517

SMILES: O=C(Cc1ccccn1)NO

InChI: InChI=1S/C7H8N2O2/c10-7(9-11)5-6-3-1-2-4-8-6/h1-4,11H,5H2,(H,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization