Molecule ID: mol34848

SMILES: COc1cccc(C#CC2CCCC2)n1

InChI: InChI=1S/C13H15NO/c1-15-13-8-4-7-12(14-13)10-9-11-5-2-3-6-11/h4,7-8,11H,2-3,5-6H2,1H3

Experimental Macro pKa Values

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