amiodarone

Ligand id: 2566

Name: amiodarone

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Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 11
Topological polar surface area 42.68
Molecular weight 645.02
XLogP 7.91
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1985))
WHO Essential Medicine WHO Model List of Essential Medicines (21st List, 2019). Access PDF version.
IUPAC Name
(2-butyl-1-benzofuran-3-yl)-[4-(2-diethylaminoethoxy)-3,5-diiodophenyl]methanone
International Nonproprietary Names
INN number INN
2012 amiodarone
Synonyms
amiodarone hydrochloride | Cordarone®
Comments
Amiodarone is a class III antiarrhythmic drug and acts as a positive inotropic agent. The prescription drug contains amiodarone hydrochloride (PubChem CID 441325).
Database Links
BindingDB Ligand 18957
CAS Registry No. 1951-25-3
ChEBI CHEBI:2663
ChEMBL Ligand CHEMBL633
DrugBank Ligand DB01118
GtoPdb PubChem SID 135649937
PubChem CID 2157
RCSB PDB Ligand BBI
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Wikipedia Amiodarone