Name: Anti-Influenza agent 6
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218849577
Cas No:2917502-08-8
常用名:Anti-Influenza agent 6
IUPAC:tert-butyl N-[(1S)-5-{[(tert-butoxy)carbonyl]amino}-1-[(7-{[4-({[(4-tert-butylphenyl)formamido]methanethioyl}amino)phenyl]carbamoyl}heptyl)carbamoyl]pentyl]carbamate
IUPAC:tert-butyl N-[(1S)-5-{[(tert-butoxy)carbonyl]amino}-1-[(7-{[4-({[(4-tert-butylphenyl)formamido]methanethioyl}amino)phenyl]carbamoyl}heptyl)carbamoyl]pentyl]carbamate
InChI key:UASQCMIAGVFPSF-XIFFEERXSA-N

分子式:C42H64N6O7S
分子量:797.07
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCCCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)cc1
SMILES:CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCCCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)cc1

Anti-Influenza agent 6 (compound 19b) 针对 A/WSN/33/H1N1 (EC50= 0.015 μM)、乙型流感病毒 Yamagata/16/88 (EC50= 0.073 μM) 以及 Victotis/2/87 (EC50= 0.067 μM) 展示了显著的抑制效果。

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