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Chemical structure of p-Ethynylphenylalanine

GC61463

p-Ethynylphenylalanine

Also known as (2S)-2-amino-3-(4-ethynylphenyl)propanoic acid

p-Ethynylphenylalanine (4-Ethynyl-L-phenylalanine) is a potent, selective, reversible and competitive inhibitor of tryptophan hydroxylase (TPH), with a Ki of 32·6 μM

ChemicalCAS278605-15-5MW189.21FormulaC11H11NO2
CAS number
278605-15-5
Molecular weight
189.21
Formula
C11H11NO2
Solubility
DMSO: 2·22 mg/mL (11·73 mM)
InChIKey
PPDNGMUGVMESGE-JTQLQIEISA-N
Catalogue number
GC61463
Brand
GLPBIO
Computed properties PubChem CID 25216972 · XLogP -1.3 · TPSA 63.3 Ų · H-bond donors 2
XLogP
-1.3
TPSA
63.3 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
14

SMILES C#CC1=CC=C(C=C1)C[C@@H](C(=O)O)N

Computed descriptors from PubChem (CID 25216972), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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