selegiline

Ligand id: 6639

Name: selegiline

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 3.24
Molecular weight 187.14
XLogP 4.48
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1996))
IUPAC Name
methyl(1-phenylpropan-2-yl)(prop-2-yn-1-yl)amine
International Nonproprietary Names
INN number INN
4436 selegiline
Synonyms
Eldepryl® | L-deprenalin | Otrasel® | Selegene® | Zelapar®
Database Links
CAS Registry No. 14611-51-9
ChEMBL Ligand CHEMBL972
DrugBank Ligand DB01037
PubChem CID 26757
Search Google for chemical match using the InChIKey MEZLKOACVSPNER-GFCCVEGCSA-N
Search Google for chemicals with the same backbone MEZLKOACVSPNER
Search PubMed clinical trials selegiline
Search PubMed titles selegiline
Search PubMed titles/abstracts selegiline
Search UniChem for chemical match using the InChIKey MEZLKOACVSPNER-GFCCVEGCSA-N
Search UniChem for chemicals with the same backbone MEZLKOACVSPNER
Wikipedia Selegiline
Comments
Marketed formulations may contain (PubChem CID 26758).