norfenfluramine   Click here for help

GtoPdb Ligand ID: 215

Synonyms: (±)-norfenfluramine
Compound class: Synthetic organic
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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 3
Topological polar surface area 26.02
Molecular weight 203.09
XLogP 2.69
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CC(Cc1cccc(c1)C(F)(F)F)N
Isomeric SMILES CC(Cc1cccc(c1)C(F)(F)F)N
InChI InChI=1S/C10H12F3N/c1-7(14)5-8-3-2-4-9(6-8)10(11,12)13/h2-4,6-7H,5,14H2,1H3
InChI Key MLBHFBKZUPLWBD-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
1-[3-(trifluoromethyl)phenyl]propan-2-amine
Synonyms Click here for help
(±)-norfenfluramine
Database Links Click here for help
CAS Registry No. 1886-26-6 (source: Scifinder)
ChEMBL Ligand CHEMBL1979333
GtoPdb PubChem SID 135650839
PubChem CID 15897
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Wikipedia Norfenfluramine