terfenadine

Ligand id: 2608

Name: terfenadine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 43.7
Molecular weight 471.31
XLogP 10.9
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA)
Withdrawn drug? Yes
IUPAC Name
1-(4-tert-butylphenyl)-4-[4-[hydroxy-di(phenyl)methyl]piperidin-1-yl]butan-1-ol
International Nonproprietary Names
INN number INN
3674 terfenadine
Synonyms
RMI-9918 | Seldane® | Triludan®
Database Links
BindingDB Ligand 50017376
CAS Registry No. 50679-08-8
ChEBI CHEBI:9453
ChEMBL Ligand CHEMBL17157
DrugBank Ligand DB00342
PubChem CID 5405
Search Google for chemical match using the InChIKey GUGOEEXESWIERI-UHFFFAOYSA-N
Search Google for chemicals with the same backbone GUGOEEXESWIERI
Search PubMed clinical trials terfenadine
Search PubMed titles terfenadine
Search PubMed titles/abstracts terfenadine
Search UniChem for chemical match using the InChIKey GUGOEEXESWIERI-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone GUGOEEXESWIERI
Wikipedia Terfenadine
Comments
Due to adverse effects on cardiac function, terfenadine has largely been superseded by fexofenadine. Terfenadine was completely withdrawn in the US in 1998.