Molecule ID: mol34498

SMILES: COc1ccc(C#Cc2ccccn2)cc1

InChI: InChI=1S/C14H11NO/c1-16-14-9-6-12(7-10-14)5-8-13-4-2-3-11-15-13/h2-4,6-7,9-11H,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.76 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization