Molecule ID: mol13791

SMILES: CC(=O)OCC1CN2CCC1CC2

InChI: InChI=1S/C10H17NO2/c1-8(12)13-7-10-6-11-4-2-9(10)3-5-11/h9-10H,2-7H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization