clemastine

Ligand id: 6063

Name: clemastine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 12.47
Molecular weight 343.17
XLogP 6.51
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1977))
IUPAC Name
(2R)-2-[2-[(1R)-1-(4-chlorophenyl)-1-phenylethoxy]ethyl]-1-methylpyrrolidine
International Nonproprietary Names
INN number INN
2231 clemastine
Synonyms
HS-592 | meclastin | Tavegil® | Tavist®
Database Links
CAS Registry No. 15686-51-8
ChEMBL Ligand CHEMBL1626
DrugBank Ligand DB00283
PubChem CID 26987
Search Google for chemical match using the InChIKey YNNUSGIPVFPVBX-NHCUHLMSSA-N
Search Google for chemicals with the same backbone YNNUSGIPVFPVBX
Search PubMed clinical trials clemastine
Search PubMed titles clemastine
Search PubMed titles/abstracts clemastine
Search UniChem for chemical match using the InChIKey YNNUSGIPVFPVBX-NHCUHLMSSA-N
Search UniChem for chemicals with the same backbone YNNUSGIPVFPVBX
Wikipedia Clemastine
Comments
Marketed formulations contain clemastine hydrogen fumarate (PubChem CID 5281069).