Name: Bis-PEG23-endo-BCN
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212667473
Cas No:
常用名:Bis-PEG23-endo-BCN
IUPAC:{bicyclo[6.1.0]non-4-yn-9-yl}methyl N-(71-{[({bicyclo[6.1.0]non-4-yn-9-yl}methoxy)carbonyl]amino}-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69-tricosaoxahenheptacontan-1-yl)carbamate
IUPAC:{bicyclo[6.1.0]non-4-yn-9-yl}methyl N-(71-{[({bicyclo[6.1.0]non-4-yn-9-yl}methoxy)carbonyl]amino}-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69-tricosaoxahenheptacontan-1-yl)carbamate
InChI key:HHOAGYKDGFYVNA-UHFFFAOYSA-N

分子式:C70H124N2O27
分子量:1425.749
氢键供体数 (HBD):2
氢键受体数 (HBA):25
LogP:2.8811378
SMILES:O=C(NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1C2CCC#CCCC12)OCC1C2CCC#CCCC12
SMILES:O=C(NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1C2CCC#CCCC12)OCC1C2CCC#CCCC12

Bis-PEG23-endo-BCN is a PEG-based linker for PROTACs which joins two essential ligands, crucial for forming PROTAC molecules. This linker enables selective protein degradation by leveraging the ubiquitin-proteasome system within cells.

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