hexahydrodifenidol

Ligand id: 322

Name: hexahydrodifenidol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 23.47
Molecular weight 315.26
XLogP 6.32
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-cyclohexyl-1-phenyl-4-piperidin-1-ylbutan-1-ol
Database Links
BindingDB Ligand 81960
CAS Registry No. 113010-69-8 (source: Scifinder)
PubChem CID 124226
Search Google for chemical match using the InChIKey ILHSFCNKNNNPRN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ILHSFCNKNNNPRN
Search UniChem for chemical match using the InChIKey ILHSFCNKNNNPRN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ILHSFCNKNNNPRN