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Chemical structure of VH 032 amide-PEG3-acid

GC50543

VH 032 amide-PEG3-acid

Also known as 3-[2-[2-[3-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-3-oxopropoxy]ethoxy]ethoxy]propanoic acid

VH 032 amide-PEG3-acid is a synthesized E3 ligase ligand-linker conjugate that incorporates the (S,R,S)-AHPC based VHL ligand and 3-unit PEG linker used in PROTAC technology

ChemicalCAS2140807-42-5MW662.79FormulaC32H46N4O9S
CAS number
2140807-42-5
Molecular weight
662.79
Formula
C32H46N4O9S
Solubility
Soluble in DMSO
InChIKey
YHEJFYORSLEJKX-BEYSDYMESA-N
Catalogue number
GC50543
Brand
GLPBIO
Computed properties PubChem CID 132020301 · XLogP 1.3 · TPSA 205 Ų · H-bond donors 4
XLogP
1.3
TPSA
205 Ų
H-bond donors
4
H-bond acceptors
11
Rotatable bonds
19
Heavy atoms
46

SMILES CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)CCOCCOCCOCCC(=O)O)O

Computed descriptors from PubChem (CID 132020301), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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