propranolol

Ligand id: 564

Name: propranolol

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 41.49
Molecular weight 259.16
XLogP 3.03
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1967), EMA (2014))
WHO Essential Medicine WHO Model List of Essential Medicines (21st List, 2019). Access PDF version.
IUPAC Name
1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol
International Nonproprietary Names
INN number INN
1940 propranolol
Synonyms
Bedranol® | Hemangiol® | Inderal® | propranolol hydrochloride
Comments
The approved drug propranolol is a racemic mixtue of (+)-propranolol and (-)-propranolol. We show the non-stereo molecule to represent the mixture.
Database Links
BindingDB Ligand 25761
CAS Registry No. 525-66-6 (source: ChEBI)
ChEBI CHEBI:8499
ChEMBL Ligand CHEMBL27
DrugBank Ligand DB00571
GtoPdb PubChem SID 135650858
PubChem CID 4946
Search Google for chemical match using the InChIKey AQHHHDLHHXJYJD-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AQHHHDLHHXJYJD
Search PubMed clinical trials propranolol
Search PubMed titles propranolol
Search PubMed titles/abstracts propranolol
Search UniChem for chemical match using the InChIKey AQHHHDLHHXJYJD-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AQHHHDLHHXJYJD
Wikipedia Propranolol