3-chloro-L-phenylalanine
(2S)-2-amino-3-(3-chlorophenyl)propanoic acid
Molecular Identity
3-chloro-L-phenylalanine
(2S)-2-amino-3-(3-chlorophenyl)propanoic acid
PubChem CID: 2761492
3-chloro-L-phenylalanine is a non-proteinogenic L-alpha-amino acid that is L-phenylalanine in which one of the meta-hydrogens of the phenyl group has been replaced by a chlorine. It is a chloroamino acid, a member of monochlorobenzenes, a non-proteinogenic L-alpha-amino acid and a L-phenylalanine derivative.
2D Structure
Properties
C9H10ClNO2
Molecular Formula
199.63
Molecular Weight
g/mol
199.0400
Exact Mass
Da
-0.5
XLogP
Drug-like (Lipinski: < 5)
63.3
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
3
H-Bond Acceptors
186
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=CC(=C1)Cl)CC(C(=O)O)NIsomeric SMILES
SMILES: C1=CC(=CC(=C1)Cl)C[C@@H](C(=O)O)NSynonyms(20)
3-chloro-L-phenylalanine(2S)-2-amino-3-(3-chlorophenyl)propanoic acidCHEBI:49597DTXSID40375800RefChem:93487DTXCID50326828887-087-680126-51-8L-3-ChlorophenylalanineH-Phe(3-Cl)-OH(S)-2-amino-3-(3-chlorophenyl)propanoic acidMFCD01075124(2S)-2-azaniumyl-3-(3-chlorophenyl)propanoateL-3-CHLOROPHEm-Chlorphenylalanin
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 3-chloro-L-phenylalanine
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