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Chemical structure of PROTAC SGK3 degrader-1

GC39426

PROTAC SGK3 degrader-1

Also known as (2S,4R)-1-[(2S)-2-[[2-[2-[2-[6-[(2R)-2-[[6-[4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenyl]-1H-pyrazolo[5,4-d]pyrimidin-4-yl]oxymethyl]morpholin-4-yl]hexoxy]ethoxy]ethoxy]acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide

PROTAC SGK3 degrader-1 (SGK3-PROTAC1), is a potent SKG3 degrader based on von Hippel-Lindau ligand· PROTAC SGK3 degrader-1 (0·3 μM) induces 50% degradation of endogenous SGK3 within 2 hours, with maximal 80% degradation observed within 8 hours, accompanied by a loss of phosphorylation of NDRG1 (an SGK3 substrate)

ChemicalCAS2381320-35-8MW1157.38FormulaC57H73FN10O11S2
CAS number
2381320-35-8
Molecular weight
1157.38
Formula
C57H73FN10O11S2
Solubility
DMSO: ≥ 100 mg/mL (86·40 mM)
InChIKey
RTFQFPZKDYMMMJ-RIAKQDHQSA-N
Catalogue number
GC39426
Brand
GLPBIO
Computed properties PubChem CID 139035049 · XLogP 6 · TPSA 298 Ų · H-bond donors 5
XLogP
6
TPSA
298 Ų
H-bond donors
5
H-bond acceptors
19
Rotatable bonds
29
Heavy atoms
81

SMILES CC1=CC(=C(C=C1)F)S(=O)(=O)NC2=CC=C(C=C2)C3=NC4=C(C=NN4)C(=N3)OC[C@H]5CN(CCO5)CCCCCCOCCOCCOCC(=O)N[C@H](C(=O)N6C[C@@H](C[C@H]6C(=O)NCC7=CC=C(C=C7)C8=C(N=CS8)C)O)C(C)(C)C

Computed descriptors from PubChem (CID 139035049), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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