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Chemical structure of MAK683-CH2CH2COOH

GC63056

MAK683-CH2CH2COOH

Also known as 3-[5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]-6-methyl-2-pyridinyl]propanoic acid

MAK683-CH2CH2COOH binds to EED (embryonic ectoderm development protein)· MAK683-CH2CH2COOH and a VHL ligand for the E3 ubiquitin ligase have been used to design PROTAC EED degrader-1 and PROTAC EED degrader-2

ChemicalCAS2639882-68-9MW448.45FormulaC23H21FN6O3
CAS number
2639882-68-9
Molecular weight
448.45
Formula
C23H21FN6O3
InChIKey
WWNHSPXQGRANDX-UHFFFAOYSA-N
Catalogue number
GC63056
Brand
GLPBIO
Computed properties PubChem CID 146014470 · XLogP 3.2 · TPSA 115 Ų · H-bond donors 2
XLogP
3.2
TPSA
115 Ų
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
33

SMILES CC1=C(C=CC(=N1)CCC(=O)O)C2=CN=C(N3C2=NN=C3)NCC4=C(C=CC5=C4CCO5)F

Computed descriptors from PubChem (CID 146014470), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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