Name: (S,R,S)-AHPC-O-Ph-PEG1-NH2
Rating: 5 (10 reviews)

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HIT ID:HIT212668308
Cas No:2361117-24-8
常用名:(S,R,S)-AHPC-O-Ph-PEG1-NH2
别名:VH032-O-Ph-PEG1-NH2
IUPAC:(2S,4R)-1-[(2S)-2-{2-[4-(2-aminoethoxy)phenoxy]acetamido}-3,3-dimethylbutanoyl]-4-hydroxy-N-{[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}pyrrolidine-2-carboxamide
IUPAC:(2S,4R)-1-[(2S)-2-{2-[4-(2-aminoethoxy)phenoxy]acetamido}-3,3-dimethylbutanoyl]-4-hydroxy-N-{[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}pyrrolidine-2-carboxamide
InChI key:UWILAIJPPCISSY-ZSOKXDGFSA-N

分子式:C32H41N5O6S
分子量:623.77
氢键供体数 (HBD):4
氢键受体数 (HBA):8
LogP:1.2316298
SMILES:Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COc2ccc(OCCN)cc2)C(C)(C)C)cc1
SMILES:Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COc2ccc(OCCN)cc2)C(C)(C)C)cc1

(S,R,S)-AHPC-O-Ph-PEG1-NH2 (VH032-O-Ph-PEG1-NH2) serves as an E3 ligase ligand-linker conjugate, integrating a VHL ligand for the E3 ubiquitin ligase and a PROTAC linker. This compound is utilized in PROTAC EED degrader-1, a PROTAC that targets EED with a potency (pKD) of 9.02[1].

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