Molecule ID: mol4392

SMILES: Cc1ccc2c(Cl)ccnc2c1

InChI: InChI=1S/C10H8ClN/c1-7-2-3-8-9(11)4-5-12-10(8)6-7/h2-6H,1H3

Experimental Macro pKa Values

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