clomipramine

Ligand id: 2398

Name: clomipramine

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Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 6.48
Molecular weight 314.15
XLogP 4.65
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1989))
WHO Essential Medicine WHO Model List of Essential Medicines (21st List, 2019). Access PDF version.
IUPAC Name
3-(9-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine
International Nonproprietary Names
INN number INN
2238 clomipramine
Synonyms
Anafranil® | G-34586
Comments
Clomipramine is a tricyclic antidepressant.
Database Links
BindingDB Ligand 50021927
CAS Registry No. 303-49-1
ChEBI CHEBI:47780
ChEMBL Ligand CHEMBL415
DrugBank Ligand DB01242
GtoPdb PubChem SID 135650111
PubChem CID 2801
RCSB PDB Ligand CXX
Search Google for chemical match using the InChIKey GDLIGKIOYRNHDA-UHFFFAOYSA-N
Search Google for chemicals with the same backbone GDLIGKIOYRNHDA
Search PubMed clinical trials clomipramine
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Search UniChem for chemical match using the InChIKey GDLIGKIOYRNHDA-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone GDLIGKIOYRNHDA
Wikipedia Clomipramine