Dapivirine

• 常用名: Dapivirine
• 英文名: Dapivirine (TMC120)
• CAS号: 244767-67-7
• 分子量: 329.398
• 密度: 1.2±0.1 g/cm3
• 沸点: 557.9±60.0 °C at 760 mmHg
• 分子式: C₂₀H₁₉N₅
• 熔点: N/A
• 闪点: 291.2±32.9 °C

Dapivirine用途

Dapivirine(TMC 120, TMC 120 R147681)是HIV非核苷逆转录酶抑制剂（NNRTI），IC50为24 nM，能抑制包括NNRTI抗性的各种HIV-1毒株。

Dapivirine名称

• 中文名: Dapivirine
• 英文名: 4-[[4-(2,4,6-trimethylanilino)pyrimidin-2-yl]amino]benzonitrile

Dapivirine生物活性

• 描述: Dapivirine(TMC 120, TMC 120 R147681)是HIV非核苷逆转录酶抑制剂(NNRTI),IC50为24 nM,能抑制包括NNRTI抗性的各种HIV-1毒株。
• 相关类别:
  信号通路 >> 抗感染 >> HIV
  信号通路 >> 抗感染 >> 逆转录酶
  研究领域 >> 感染
• 参考文献:

  [1]. Van Herrewege Y, et al. In vitro evaluation of nonnucleoside reverse transcriptase inhibitors UC-781 and TMC120-R147681 as human immunodeficiency virus microbicides. Antimicrob Agents Chemother. 2004 Jan;48(1):337-9.

  [2]. Fletcher P, et al. Inhibition of human immunodeficiency virus type 1 infection by the candidate microbicide dapivirine, a nonnucleoside reverse transcriptase inhibitor. Antimicrob Agents Chemother. 2009 Feb;53(2):487-95.

  [3]. Di Fabio S, et al. Inhibition of vaginal transmission of HIV-1 in hu-SCID mice by the non-nucleoside reverse transcriptase inhibitor TMC120 in a gel formulation. AIDS. 2003 Jul 25;17(11):1597-604.

  [4]. Nel AM, et al. Pharmacokinetics of 2 dapivirine vaginal microbicide gels and their safety vs. Hydroxyethyl cellulose-based universal placebo gel. J Acquir Immune Defic Syndr. 2010 Oct;55(2):161-9.

Dapivirine物理化学性质

• 密度: 1.2±0.1 g/cm3
• 沸点: 557.9±60.0 °C at 760 mmHg
• 分子式: C₂₀H₁₉N₅
• 分子量: 329.398
• 闪点: 291.2±32.9 °C
• 精确质量: 329.164032
• PSA: 73.63000
• LogP: 3.98
• InChIKey: ILAYIAGXTHKHNT-UHFFFAOYSA-N
• SMILES: Cc1cc(C)c(Nc2ccnc(Nc3ccc(C#N)cc3)n2)c(C)c1
• 蒸汽压: 0.0±1.5 mmHg at 25°C
• 折射率: 1.649
• 储存条件: -20°C

Dapivirine安全信息

• 危害码 (欧洲): Xi

Dapivirine靶点实验

查看更多实验

实验名称：Antiviral activity against wild type HIV1 3B infected in human MT2 cells assessed as ... 来源：ChEMBL 靶标：Human immunodeficiency virus 1 External Id：CHEMBL2422881

实验名称：Antiviral activity against HIV1 3B harboring reverse transcriptase K103N/Y181C double... 来源：ChEMBL 靶标：Human immunodeficiency virus 1 External Id：CHEMBL2422880

实验名称：Cytotoxicity against human MT2 cells assessed as growth inhibition 来源：ChEMBL 靶标：MT2 External Id：CHEMBL2422879

实验名称：Antiviral activity against HIV1 3B harboring reverse transcriptase Y181C mutant infec... 来源：ChEMBL 靶标：Human immunodeficiency virus 1 External Id：CHEMBL2422883

实验名称：Effective concentration of the compound to inhibit HIV-1 mutant LAI replication in HI... 来源：ChEMBL 靶标：MT4 External Id：CHEMBL834372

实验名称：Aqueous solubility of the compound in Britton-Robinson buffer at pH 6.5 after 48 hrs ... 来源：ChEMBL 靶标：N/A External Id：CHEMBL2422877

实验名称：Inhibition of HIV reverse transcriptase 来源：ChEMBL 靶标：N/A External Id：CHEMBL987017

实验名称：Partition coefficient, log P of the compound 来源：ChEMBL 靶标：N/A External Id：CHEMBL987018

实验名称：Effective concentration of the compound to inhibit HIV-1 mutant L100I replication in ... 来源：ChEMBL 靶标：MT4 External Id：CHEMBL834477

实验名称：Effective concentration of the compound to inhibit HIV-1 mutant K103N replication in ... 来源：ChEMBL 靶标：MT4 External Id：CHEMBL834476

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Dapivirine英文别名

• 4-{[4-(Mesitylamino)-2-pyrimidinyl]amino}benzonitrile
• 4-({4-[(2,4,6-trimethylphenyl)amino]pyrimidin-2-yl}amino)benzenecarbonitrile
• Dapivirine (TMC120)
• TMC120
• R-147681
• 4-[[4-[(2,4,6-trimethylphenyl)amino]-2-pyrimidinyl]amino]benzonitrile
• UNII: TCN4MG2VXS
• Dapivirine
• 4-{[4-(Mesitylamino)pyrimidin-2-yl]amino}benzonitrile
• UNII-TCN4MG2VXS
• dapivirinum