carazolol

Ligand id: 569

Name: carazolol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 57.28
Molecular weight 298.17
XLogP 3.25
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
1-(9H-carbazol-4-yloxy)-3-(propan-2-ylamino)propan-2-ol
International Nonproprietary Names
INN number INN
4036 carazolol
Synonyms
BM-51052 | conducton | corazolol
Database Links
BindingDB Ligand 50027663
CAS Registry No. 51997-43-4
ChEMBL Ligand CHEMBL324665
PubChem CID 71739
Search Google for chemical match using the InChIKey BQXQGZPYHWWCEB-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BQXQGZPYHWWCEB
Search PubMed clinical trials carazolol
Search PubMed titles carazolol
Search PubMed titles/abstracts carazolol
Search UniChem for chemical match using the InChIKey BQXQGZPYHWWCEB-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BQXQGZPYHWWCEB
SynPHARM 80268 (in complex with β2-adrenoceptor)
Wikipedia Carazolol
Comments
The INN-assigned compound carazolol is a racemic mixture of two enantiomers. The structure shown here does not specify stereochemisty and represents the mixture. The two enantiomers are represented on PubChem by CID 13023332 and CID 13023331. Please note that the PDB entry for this ligand linked to above specifies the S isomer (CID 13023332).