selegiline   Click here for help

GtoPdb Ligand ID: 6639

Synonyms: Eldepryl® | L-deprenalin | Otrasel® | Selegene® | Zelapar®
Approved drug
selegiline is an approved drug (FDA (1996))
Compound class: Synthetic organic
Comment: Marketed formulations may contain (PubChem CID 26758).
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 3.24
Molecular weight 187.14
XLogP 2.66
No. Lipinski's rules broken 0
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Canonical SMILES CC(N(CC#C)C)Cc1ccccc1
Isomeric SMILES C[C@@H](N(CC#C)C)Cc1ccccc1
InChI InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3/t12-/m1/s1
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1996))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
4436 selegiline
Synonyms Click here for help
Eldepryl® | L-deprenalin | Otrasel® | Selegene® | Zelapar®
Database Links Click here for help
CAS Registry No. 14611-51-9
DrugBank Ligand DB01037
DrugCentral Ligand 2429
GtoPdb PubChem SID 178103252
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
UniChem Compound Search for chemical match using the InChIKey MEZLKOACVSPNER-GFCCVEGCSA-N
UniChem Connectivity Search for chemical match using the InChIKey MEZLKOACVSPNER-GFCCVEGCSA-N
Wikipedia Selegiline