Molecule ID: mol26359

SMILES: On1cnc2ccccc21

InChI: InChI=1S/C7H6N2O/c10-9-5-8-6-3-1-2-4-7(6)9/h1-5,10H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization