Molecule ID: mol4553

SMILES: c1ccc2nnccc2c1

InChI: InChI=1S/C8H6N2/c1-2-4-8-7(3-1)5-6-9-10-8/h1-6H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.27 IUPAC digitized pKa 1 » 0
2.29 QSARToolbox 1 » 0
2.29 Datawarrior 1 » 0
2.29 OCHEM 1 » 0
2.37 IUPAC digitized pKa 1 » 0
2.45 AttenGpKa training set 1 » 0
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Charge States and Microspecies Visualization