fenfluramine   Click here for help

GtoPdb Ligand ID: 4613

Synonyms: Adifax® | Fintepla® | Pondimin® | ZX008
Approved drug
fenfluramine is an approved drug (FDA (2020))
Compound class: Synthetic organic
Comment: The approved drug was called dexfenfluramine, but was withdrawn from use due to adverse cardiac events [1,3].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 12.03
Molecular weight 231.12
XLogP 3.5
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CCNC(Cc1cccc(c1)C(F)(F)F)C
Isomeric SMILES CCNC(Cc1cccc(c1)C(F)(F)F)C
InChI InChI=1S/C12H16F3N/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9,16H,3,7H2,1-2H3
InChI Key DBGIVFWFUFKIQN-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2020))
IUPAC Name Click here for help
ethyl({1-[3-(trifluoromethyl)phenyl]propan-2-yl})amine
International Nonproprietary Names Click here for help
INN number INN
5818 dexfenfluramine
1596 fenfluramine
Synonyms Click here for help
Adifax® | Fintepla® | Pondimin® | ZX008
Database Links Click here for help
CAS Registry No. 458-24-2 (source: Scifinder)
ChEBI CHEBI:5000
ChEMBL Ligand CHEMBL87493
DrugBank Ligand DB01191
DrugCentral Ligand 1150
GtoPdb PubChem SID 178101333
PubChem CID 3337
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Wikipedia Fenfluramine