Molecule ID: mol7863

SMILES: N#Cc1ncc2ccccc2n1

InChI: InChI=1S/C9H5N3/c10-5-9-11-6-7-3-1-2-4-8(7)12-9/h1-4,6H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
-2.56 IUPAC digitized pKa 1 » 0
-2.56 OCHEM 1 » 0
-2.56 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization