fenclonine   Click here for help

GtoPdb Ligand ID: 5240

Synonyms: 4-chlorophenylalanine | p-Chlorophenylalanine | para-chlorophenylalanine | PCPA
Compound class: Synthetic organic
Comment: A synthetic amino acid which covalently binds to tryptophan hydroxylase to cause depletion of serotonin in the brain [1].
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 63.32
Molecular weight 199.04
XLogP -0.76
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES NC(C(=O)O)Cc1ccc(cc1)Cl
Isomeric SMILES NC(C(=O)O)Cc1ccc(cc1)Cl
InChI InChI=1S/C9H10ClNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)
InChI Key NIGWMJHCCYYCSF-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
2-amino-3-(4-chlorophenyl)propanoic acid
International Nonproprietary Names Click here for help
INN number INN
2382 fenclonine
Synonyms Click here for help
4-chlorophenylalanine | p-Chlorophenylalanine | para-chlorophenylalanine | PCPA
Database Links Click here for help
CAS Registry No. 7424-00-2
ChEMBL Ligand CHEMBL1256351
GtoPdb PubChem SID 178101924
PubChem CID 4652
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Wikipedia Fenclonine

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Tocris
p-Chlorophenylalanine
Cat. No. 0938