(-)-propranolol

Ligand id: 63

Name: (-)-propranolol

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 4.05
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol
International Nonproprietary Names
INN number INN
1940 propranolol
Database Links
BindingDB Ligand 50246936
CAS Registry No. 4199-09-1 (source: Scifinder)
ChEMBL Ligand CHEMBL452861
DrugBank Ligand DB00571
PubChem CID 91536
RCSB PDB Ligand SNP
Search Google for chemical match using the InChIKey AQHHHDLHHXJYJD-AWEZNQCLSA-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-AWEZNQCLSA-N
Search UniChem for chemicals with the same backbone AQHHHDLHHXJYJD
Wikipedia Propanolol
Comments
A component of the approved drug propranolol. Propranolol is a racemic mixture of two enantiomers (+)-propranolol, and (-)-propranolol. Some of the database entries linked to from this page may refer to the mixture and do not specify stereochemistry in the images of the structue shown.