Molecule ID: mol4370

SMILES: Clc1ccnc2cc(Br)ccc12

InChI: InChI=1S/C9H5BrClN/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.83 QSARToolbox 1 » 0
2.83 IUPAC digitized pKa 1 » 0
2.83 OCHEM 1 » 0
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Charge States and Microspecies Visualization