Name: ZINC08383544
Rating: 5 (10 reviews)

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HIT ID:HIT105330222
Cas No:618361-63-0
常用名:ZINC08383544
IUPAC:4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-[4-(pentyloxy)phenyl]-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one
IUPAC:4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-[4-(pentyloxy)phenyl]-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one
InChI key:UEEMPANMROSHCK-UHFFFAOYSA-N

分子式:C30H30N2O6
分子量:514.578
氢键供体数 (HBD):1
氢键受体数 (HBA):5
LogP:3.94
SMILES:CCCCCOc1ccc(cc1)C1N(Cc2cccnc2)C(=O)C(O)=C1C(=O)c1ccc2OCCOc2c1 |c:26|
SMILES:CCCCCOc1ccc(cc1)C1N(Cc2cccnc2)C(=O)C(O)=C1C(=O)c1ccc2OCCOc2c1 |c:26|

ZINC08383544 is a specific pyruvate kinase M2 activator which promotes the formation of PKM2 tetramer. ZINC08383544 effectively blocks PKM2 nuclear translocation, and inhibits the growth of tumor.

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