Molecule ID: mol7494

SMILES: COc1ncc(-c2ccccc2)cn1

InChI: InChI=1S/C11H10N2O/c1-14-11-12-7-10(8-13-11)9-5-3-2-4-6-9/h2-8H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
0.79 OCHEM 1 » 0
0.79 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization