carteolol   Click here for help

GtoPdb Ligand ID: 7142

Synonyms: ABBOTT-43326 | Cartrol® | Ocupress® | OPC-1085
Approved drug
carteolol is an approved drug (FDA (1988))
Compound class: Synthetic organic
Comment: Carteolol is a β-blocker, selective for β1-adrenoceptors in cardiac tissue.
Click here for help
IUPHAR Pharmacology Education Project (PEP) logo

View more information in the IUPHAR Pharmacology Education Project: carteolol

2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 74.08
Molecular weight 292.18
XLogP 1.41
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Click here for help
Canonical SMILES OC(COc1cccc2c1CCC(=N2)O)CNC(C)(C)C
Isomeric SMILES OC(COc1cccc2c1CCC(=N2)O)CNC(C)(C)C
InChI InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20)
InChI Key LWAFSWPYPHEXKX-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1988))
IUPAC Name Click here for help
5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydroquinolin-2-ol
International Nonproprietary Names Click here for help
INN number INN
3990 carteolol
Synonyms Click here for help
ABBOTT-43326 | Cartrol® | Ocupress® | OPC-1085
Database Links Click here for help
CAS Registry No. 51781-06-7
ChEMBL Ligand CHEMBL839
DrugBank Ligand DB00521
DrugCentral Ligand 520
GtoPdb PubChem SID 178103718
PubChem CID 2583
Search Google for chemical match using the InChIKey LWAFSWPYPHEXKX-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LWAFSWPYPHEXKX
Search PubMed clinical trials carteolol
Search PubMed titles carteolol
Search PubMed titles/abstracts carteolol
UniChem Compound Search for chemical match using the InChIKey LWAFSWPYPHEXKX-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey LWAFSWPYPHEXKX-UHFFFAOYSA-N
Wikipedia Carteolol