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CI-39

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Category Human immunodeficiency Virus (HIV)
CAS 2132412-25-8
Description CI-39 is an antiviral natural product. CI-39 is an NNRTI (non-nucleoside reverse transcriptase inhibit) antiviral agent with an EC50 of 3.40 µM and an CC50 of >30 µM for wild type HIV-1. CI-39 inhibits HIV-1 RT DNA polymerase and ribonuclease H activitiessup.
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Product Information

Synonyms CI-39|CHEMBL4792750|HY-146364|CS-0498478|methyl 2-[[2-(1-methoxyindol-3-yl)acetyl]amino]benzoate
Molecular Weight 338.36
Molecular Formula C19H18N2O4
Canonical SMILES COC(=O)C1=CC=CC=C1NC(=O)CC2=CN(C3=CC=CC=C32)OC
Purity ≥98% (HPLC)
Solubility In vitro:
10 mM in DMSO
Appearance Solid powder
Storage Store at -20°C
Complexity 484
Exact Mass 338.12665706
In Vitro CI-39 (0-100 µM) inhibits HIV-1 RT DNA polymerase and ribonuclease H activities with EC50s of 7.20, >30 µM, respectively.
CI-39 shows antiviral activities with EC50s of 3.37, 3.00, 2.41, 3.08, 2.14, 3.27, 3.19, 4.07 µM for VSVG/HIV-1wt, VSVG/HIV-1RT-K103N, VSVG/HIV-1wtRT-K103N, VSVG/HIV-1RT-K1RT-Y181C, VSVG/HIV-1RT-K1RT-K103N,Y181C, VSVG/HIV-1RT-K103N,Y181C, VSVG/HIV-1RT-L100I,K103N, VSVG/HIV-1RT-Y188L, VSVG/HIV-1RT-K103N,G190A, VSVG/HIV-1RT-K103N,V108I, respectively.
Target HIV-1 (WT): 3.40 μM (EC50)
HIV-1 (WT): >30 μM (CC50)
XLogP3-AA 3.6

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