desloratadine

Ligand id: 7157

Name: desloratadine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 0
Topological polar surface area 24.92
Molecular weight 310.12
XLogP 3.64
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA and EMA (2001))
IUPAC Name
8-chloro-11-piperidin-4-ylidene-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridine
International Nonproprietary Names
INN number INN
7817 desloratadine
Synonyms
Clarinex® | SCH-34117
Database Links
CAS Registry No. 100643-71-8
ChEMBL Ligand CHEMBL1172
DrugBank Ligand DB00967
GtoPdb PubChem SID 178103732
PubChem CID 124087
Search Google for chemical match using the InChIKey JAUOIFJMECXRGI-UHFFFAOYSA-N
Search Google for chemicals with the same backbone JAUOIFJMECXRGI
Search PubMed clinical trials desloratadine
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Search UniChem for chemical match using the InChIKey JAUOIFJMECXRGI-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone JAUOIFJMECXRGI
Wikipedia Desloratadine
Comments
Desloratadine is a tricyclic H1-antihistamine. It is the major metabolite of loratadine.