alprenolol

Ligand id: 563

Name: alprenolol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 41.49
Molecular weight 249.17
XLogP 3.27
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-ol
International Nonproprietary Names
INN number INN
2461 alprenolol
Synonyms
Atenenol®
Database Links
BindingDB Ligand 25764
CAS Registry No. 13655-52-2 (source: Scifinder)
ChEBI CHEBI:51211
ChEMBL Ligand CHEMBL266195
DrugBank Ligand DB00866
PharmGKB Drug PA164750541
PubChem CID 2119
Search Google for chemical match using the InChIKey PAZJSJFMUHDSTF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PAZJSJFMUHDSTF
Search PubMed clinical trials alprenolol
Search PubMed titles alprenolol
Search PubMed titles/abstracts alprenolol
Wikipedia Alprenolol
Comments
The approved drug alprenolol is a racemic mixture of the R and S isomers. We show the non-stereo structure to represent the mixture.