Molecule ID: mol24795

SMILES: CC[N+](O)(CC)c1ccc(C)cc1

InChI: InChI=1S/C11H18NO/c1-4-12(13,5-2)11-8-6-10(3)7-9-11/h6-9,13H,4-5H2,1-3H3/q+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization