levosalbutamol

Ligand id: 9816

Name: levosalbutamol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 4
Rotatable bonds 5
Topological polar surface area 72.72
Molecular weight 239.15
XLogP 1.17
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (prior to 1999))
IUPAC Name
4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol
International Nonproprietary Names
INN number INN
7681 levosalbutamol
Synonyms
(-)-albuterol | (-)-salbutamol | (R)-salbutamol | levalbuterol | Xopenex®
Comments
Levosalbutamol is a short-acting β2-adrenoceptor agonist used in anti-asthma medications. Structurally it is the R enantiomer of the racemic mixture that has the INN salbutamol. Levosalbutamol belongs to the 'short-acting beta-agonist' (SABA) drug family.
Database Links
BindingDB Ligand 50361247
CAS Registry No. 34391-04-3 (source: WHO INN record)
ChEMBL Ligand CHEMBL1002
GtoPdb PubChem SID 354702288
PubChem CID 123600
RCSB PDB Ligand 68H
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