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Chemical structure of E3 Ligase Ligand-Linker Conjugates 1

GC32779

E3 Ligase Ligand-Linker Conjugates 1

Also known as 2-[2-[2-[2-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]ethoxy]ethoxy]ethoxy]ethoxy]acetic acid

E3 Ligase Ligand-Linker Conjugates 1 is a synthesized E3 ligase ligand-linker conjugate that incorporates the Pomalidomide based cereblon ligand and 4-unit PEG linker used in PROTAC technology

ChemicalCAS2097938-44-6MW507.49FormulaC23H29N3O10
CAS number
2097938-44-6
Molecular weight
507.49
Formula
C23H29N3O10
Solubility
DMSO : 50 mg/mL (98·52 mM)
InChIKey
ZXAUDUQJSKVKNG-UHFFFAOYSA-N
Catalogue number
GC32779
Brand
GLPBIO
Computed properties PubChem CID 126843533 · XLogP -0.1 · TPSA 170 Ų · H-bond donors 3
XLogP
-0.1
TPSA
170 Ų
H-bond donors
3
H-bond acceptors
11
Rotatable bonds
16
Heavy atoms
36

SMILES C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NCCOCCOCCOCCOCC(=O)O

Computed descriptors from PubChem (CID 126843533), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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