Name: (S,R,S)-AHPC-Me-CO-CH2-PEG3-NH2
Rating: 5 (10 reviews)

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HIT ID:HIT214323429
Cas No:2409538-69-6
常用名:(S,R,S)-AHPC-Me-CO-CH2-PEG3-NH2
别名:(S,R,S)-AHPC-Me-CO-CH2-PEG3-NH2
IUPAC:(2S,4R)-1-[(2S)-2-(2-{2-[2-(2-aminoethoxy)ethoxy]ethoxy}acetamido)-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide
IUPAC:(2S,4R)-1-[(2S)-2-(2-{2-[2-(2-aminoethoxy)ethoxy]ethoxy}acetamido)-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide
InChI key:SIIIUIAOOHNPNB-MPLXTJOBSA-N

分子式:C31H47N5O7S
分子量:633.81
氢键供体数 (HBD):4
氢键受体数 (HBA):9
LogP:1.626
SMILES:C[C@H](NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](NC(=O)COCCOCCOCCN)C(C)(C)C)c1ccc(cc1)-c1scnc1C |@:28|
SMILES:C[C@H](NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](NC(=O)COCCOCCOCCN)C(C)(C)C)c1ccc(cc1)-c1scnc1C |@:28|

(S,R,S)-AHPC-Me-CO-CH2-PEG3-NH2 is a synthetic E3 ligase ligand-linker conjugate comprised of a VHL ligand and a linker. It is utilized in PROTAC BRD4 Degrader-5 and PROTAC BRD4 Degrader-5-CO-PEG3-N3.

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