carvacrol

Ligand id: 2497

Name: carvacrol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 20.23
Molecular weight 150.1
XLogP 3.56
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
IUPAC Name
2-methyl-5-propan-2-ylphenol
Database Links
BindingDB Ligand 50240433
CAS Registry No. 499-75-2 (source: NCI)
ChEBI CHEBI:3440
ChEMBL Ligand CHEMBL281202
PubChem CID 10364
Search Google for chemical match using the InChIKey RECUKUPTGUEGMW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RECUKUPTGUEGMW
Search UniChem for chemical match using the InChIKey RECUKUPTGUEGMW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone RECUKUPTGUEGMW
Wikipedia Carvacrol