[3H]CP55940

Ligand id: 734

Name: [3H]CP55940    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 60.69
Molecular weight 376.3
XLogP 7.46
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[(1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl]-5-(2-methyloctan-2-yl)phenol
Database Links
ChEMBL Ligand CHEMBL559612
GtoPdb PubChem SID 135651145
PubChem CID 104895
Search Google for chemical match using the InChIKey YNZFFALZMRAPHQ-SYYKKAFVSA-N
Search Google for chemicals with the same backbone YNZFFALZMRAPHQ
Search UniChem for chemical match using the InChIKey YNZFFALZMRAPHQ-SYYKKAFVSA-N
Search UniChem for chemicals with the same backbone YNZFFALZMRAPHQ