Molecule ID: mol27935

SMILES: COC(=N)c1ccccc1

InChI: InChI=1S/C8H9NO/c1-10-8(9)7-5-3-2-4-6-7/h2-6,9H,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.60 AttenGpKa training set 1 » 0
6.10 OCHEM 1 » 0
6.10 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization