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Chemical structure of H-Ile-Trp-OH

GA22579

H-Ile-Trp-OH

Also known as (2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid

H-Ile-Trp-OH (H-Ile-Trp-OH) is an orally active α7 nAChR negative alteration modulator (NAM) with no apparent side effects

ChemicalCAS13589-06-5MW317.39FormulaC17H23N3O3
CAS number
13589-06-5
Molecular weight
317.39
Formula
C17H23N3O3
Solubility
DMSO ： 125 mg/mL (393·85 mM; Need ultrasonic)
InChIKey
BVRPESWOSNFUCJ-LKTVYLICSA-N
Catalogue number
GA22579
Brand
GLPBIO
Computed properties PubChem CID 7019085 · XLogP -0.9 · TPSA 108 Ų · H-bond donors 4
XLogP
-0.9
TPSA
108 Ų
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
23

SMILES CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)N

Computed descriptors from PubChem (CID 7019085), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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