linalool

Ligand id: 2469

Name: linalool

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 20.23
Molecular weight 154.14
XLogP 2.47
No. Lipinski's rules broken 0

Molecular properties generated using the CDK
Classification
Compound class Synthetic organic
IUPAC Name
3,7-Dimethylocta-1,6-dien-3-ol
Database Links
CAS Registry No. 78-70-6 (source: ChEBI)
ChEBI CHEBI:17580
ChEMBL Ligand CHEMBL25306
GtoPdb PubChem SID 135650522
PubChem CID 6549
Search Google for chemical match using the InChIKey CDOSHBSSFJOMGT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone CDOSHBSSFJOMGT
Search UniChem for chemical match using the InChIKey CDOSHBSSFJOMGT-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone CDOSHBSSFJOMGT
Wikipedia Linalool