Molecule ID: mol24727

SMILES: Cc1ccc(NO)cc1

InChI: InChI=1S/C7H9NO/c1-6-2-4-7(8-9)5-3-6/h2-5,8-9H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization