Name: MIR96-IN-1
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212672547
Cas No:1311982-88-3
常用名:MIR96-IN-1
IUPAC:N-(3-azidopropyl)-4-{2,6-di-tert-butyl-4-[6-(4-methylpiperazin-1-yl)-1H-1,3-benzodiazol-2-yl]phenoxy}butanamide
IUPAC:N-(3-azidopropyl)-4-{2,6-di-tert-butyl-4-[6-(4-methylpiperazin-1-yl)-1H-1,3-benzodiazol-2-yl]phenoxy}butanamide
InChI key:LTPQCIXFOJELHJ-UHFFFAOYSA-N

分子式:C33H48N8O2
分子量:588.801
氢键供体数 (HBD):2
氢键受体数 (HBA):7
LogP:5.7824717
SMILES:CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1cc(c(OCCCC(=O)NCCCN=[N+]=[N-])c(c1)C(C)(C)C)C(C)(C)C
SMILES:CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1cc(c(OCCCC(=O)NCCCN=[N+]=[N-])c(c1)C(C)(C)C)C(C)(C)C

MIR96-IN-1 selectively inhibits biogenesis of microRNA-96, upregulating a protein target (FOXO1) and inducing apoptosis in cancer cells.

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