Molecule ID: mol38009

SMILES: C(C#Cc1ccncc1)#Cc1ccccc1

InChI: InChI=1S/C15H9N/c1-2-6-14(7-3-1)8-4-5-9-15-10-12-16-13-11-15/h1-3,6-7,10-13H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.69 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization