Molecule ID: mol13999

SMILES: NC(=O)C1CC2CCN1CC2

InChI: InChI=1S/C8H14N2O/c9-8(11)7-5-6-1-3-10(7)4-2-6/h6-7H,1-5H2,(H2,9,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization