carazolol   Click here for help

GtoPdb Ligand ID: 569

Synonyms: BM-51052 | conducton | corazolol
Approved drug
carazolol is an approved drug
Compound class: Synthetic organic
Comment: 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).
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 57.28
Molecular weight 298.17
XLogP 3.27
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OC(COc1cccc2c1c1ccccc1[nH]2)CNC(C)C
Isomeric SMILES OC(COc1cccc2c1c1ccccc1[nH]2)CNC(C)C
InChI InChI=1S/C18H22N2O2/c1-12(2)19-10-13(21)11-22-17-9-5-8-16-18(17)14-6-3-4-7-15(14)20-16/h3-9,12-13,19-21H,10-11H2,1-2H3
InChI Key BQXQGZPYHWWCEB-UHFFFAOYSA-N
No information available.
Summary of Clinical Use Click here for help
Used in the treatment of cardiovascular disoders. There is no information regarding approval for clinical use of this drug on the US FDA or European Medicines Agency websites. It appears that this drug is only used in veterinary practice.
Mechanism Of Action and Pharmacodynamic Effects Click here for help
β-adrenoceptor antagonist (beta-blocker) [1].