celiprolol   Click here for help

GtoPdb Ligand ID: 9064

Synonyms: Celectol® | REV 5320 | Selectol® | ST-1396 | ST1396
Approved drug
celiprolol is an approved drug (UK (2009))
Compound class: Synthetic organic
Comment: Celiprolol is a cardioselective β1-adrenoceptor antagonist, but also displays weak partial agonist (sympathomimetic) action at β2-adrenoceptors.
Click here for help
IUPHAR Pharmacology Education Project (PEP) logo

View more information in the IUPHAR Pharmacology Education Project: celiprolol

2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 12
Topological polar surface area 90.9
Molecular weight 379.25
XLogP 1.94
No. Lipinski's rules broken 0
Click here for help
Canonical SMILES CCN(C(=O)Nc1ccc(c(c1)C(=O)C)OCC(CNC(C)(C)C)O)CC
Isomeric SMILES CCN(C(=O)Nc1ccc(c(c1)C(=O)C)OCC(CNC(C)(C)C)O)CC
InChI InChI=1S/C20H33N3O4/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26)
No information available.
Summary of Clinical Use Click here for help
Approved in many countries where it is used to manage mild to moderate hypertension. Celiprolol is not approved by the US FDA.