Molecule ID: mol27344

SMILES: CCOC(=O)C(C#N)C(C#N)(c1ccccc1)c1ccccc1

InChI: InChI=1S/C19H16N2O2/c1-2-23-18(22)17(13-20)19(14-21,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,2H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization