Name: DENV-IN-2
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214323265
Cas No:2253675-62-4
常用名:DENV-IN-2
IUPAC:(1R,2R)-2-[(3-{[(1S)-1-(4-chlorophenyl)-2-oxo-2-[6-(trifluoromethoxy)-2,3-dihydro-1H-indol-1-yl]ethyl]amino}-5-methoxyphenoxy)methyl]cyclopropane-1-carboxylic acid
IUPAC:(1R,2R)-2-[(3-{[(1S)-1-(4-chlorophenyl)-2-oxo-2-[6-(trifluoromethoxy)-2,3-dihydro-1H-indol-1-yl]ethyl]amino}-5-methoxyphenoxy)methyl]cyclopropane-1-carboxylic acid
InChI key:DPLSNZRPHADTGY-FODJJAHYSA-N

分子式:C29H26ClF3N2O6
分子量:590.98
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COc1cc(N[C@H](C(=O)N2CCc3ccc(OC(F)(F)F)cc23)c2ccc(Cl)cc2)cc(OC[C@@H]2C[C@H]2C(O)=O)c1
SMILES:COc1cc(N[C@H](C(=O)N2CCc3ccc(OC(F)(F)F)cc23)c2ccc(Cl)cc2)cc(OC[C@@H]2C[C@H]2C(O)=O)c1

DENV-IN-2 is a highly effective inhibitor of dengue viral replication with a potency indicated by an EC 50 of 0.016 nM. It exhibits significant activity against all four serotypes of the Dengue virus, with EC 50 values ranging from 0.013 to 0.029 nM.

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