Name: Tri(Mal-PEG2-amide)-amine
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212668466
Cas No:
常用名:Tri(Mal-PEG2-amide)-amine
IUPAC:N-{2-[bis({2-[3-(2-{2-[3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamido]ethoxy}ethoxy)propanamido]ethyl})amino]ethyl}-3-(2-{2-[3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamido]ethoxy}ethoxy)propanamide
IUPAC:N-{2-[bis({2-[3-(2-{2-[3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamido]ethoxy}ethoxy)propanamido]ethyl})amino]ethyl}-3-(2-{2-[3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamido]ethoxy}ethoxy)propanamide
InChI key:FIQXEOSOGUMXAI-UHFFFAOYSA-N

分子式:C48H72N10O18
分子量:1077.156
氢键供体数 (HBD):6
氢键受体数 (HBA):19
LogP:-7.052562
SMILES:O=C(CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O)NCCN(CCNC(=O)CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O)CCNC(=O)CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O |c:18,48,74|
SMILES:O=C(CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O)NCCN(CCNC(=O)CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O)CCNC(=O)CCOCCOCCNC(=O)CCN1C(=O)C=CC1=O |c:18,48,74|

Tri(Mal-PEG2-amide)-amine is a polyethylene glycol (PEG)-derived linker commonly employed for synthesizing proteolysis-targeting chimeras (PROTACs)[1].

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