ethanol

Ligand id: 2299

Name: ethanol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 0
Topological polar surface area 20.23
Molecular weight 46.04
XLogP -0.08
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
ethanol
Database Links
CAS Registry No. 64-17-5 (source: DrugBank)
ChEBI CHEBI:16236
ChEMBL Ligand CHEMBL545
DrugBank Ligand DB00898
Human Metabolome Database HMDB00108
PharmGKB Drug PA448073
PubChem CID 702
RCSB PDB Ligand EOH
Search Google for chemical match using the InChIKey LFQSCWFLJHTTHZ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LFQSCWFLJHTTHZ
Wikipedia Ethanol
Comments
The US FDA granted approval for the use of an injectable formulation of ethanol (alcohol) in dextrose solution, but marketing has been discontinued.