Name: PROTAC IRAK4 degrader-1
Rating: 5 (10 reviews)

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HIT ID:HIT212666608
Cas No:2360533-90-8
常用名:PROTAC IRAK4 degrader-1
IUPAC:2-{2-[(cyclopropylmethyl)amino]pyridin-4-yl}-N-{1-[4-({3-[4-({[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}methyl)-1H-imidazol-1-yl]propyl}carbamoyl)phenyl]-3-(trifluoromethyl)-1H-pyrazol-4-yl}-1,3-oxazole-4-carboxamide
IUPAC:2-{2-[(cyclopropylmethyl)amino]pyridin-4-yl}-N-{1-[4-({3-[4-({[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}methyl)-1H-imidazol-1-yl]propyl}carbamoyl)phenyl]-3-(trifluoromethyl)-1H-pyrazol-4-yl}-1,3-oxazole-4-carboxamide
InChI key:YXSXFMHKDNIZFS-UHFFFAOYSA-N

分子式:C44H39F3N12O7
分子量:904.868
氢键供体数 (HBD):5
氢键受体数 (HBA):12
LogP:3.409688
SMILES:FC(F)(F)c1nn(cc1NC(=O)c1coc(n1)-c1ccnc(NCC2CC2)c1)-c1ccc(cc1)C(=O)NCCCn1cnc(CNc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)c1
SMILES:FC(F)(F)c1nn(cc1NC(=O)c1coc(n1)-c1ccnc(NCC2CC2)c1)-c1ccc(cc1)C(=O)NCCCn1cnc(CNc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)c1

PROTAC IRAK4 degrader-1 (compound I-210) 是一种基于 Cereblon 的PROTAC，由 IRAK4 配体PROTAC IRAK4 ligand-1，E3 连接酶配体Pomalidomide和PROTAC linker AM-Imidazole-PA-Boc组成。

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