Molecule ID: mol30261

SMILES: CC(C)(C)OCC1CN=C(N)O1

InChI: InChI=1S/C8H16N2O2/c1-8(2,3)11-5-6-4-10-7(9)12-6/h6H,4-5H2,1-3H3,(H2,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization