Molecule ID: mol24562

SMILES: OC(O)C12CCN(CC1)CC2

InChI: InChI=1S/C8H15NO2/c10-7(11)8-1-4-9(5-2-8)6-3-8/h7,10-11H,1-6H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization