compound 17 [PMID: 8709131]

Ligand id: 3093

Name: compound 17 [PMID: 8709131]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 3.24
Molecular weight 291.2
XLogP 8.52
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[2-(4-phenylphenyl)ethyl]-1-azabicyclo[2.2.2]octane
Database Links
ChEMBL Ligand CHEMBL322868
GtoPdb PubChem SID 135649716
PubChem CID 19077556
Search Google for chemical match using the InChIKey DZTCLALNSKOSGM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DZTCLALNSKOSGM
Search UniChem for chemical match using the InChIKey DZTCLALNSKOSGM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DZTCLALNSKOSGM