Molecule ID: mol30255

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

InChI: InChI=1S/C7H14N2O2/c1-5(2)10-4-6-3-9-7(8)11-6/h5-6H,3-4H2,1-2H3,(H2,8,9)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization