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HIT103095149
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HIT103095149
  • HIT ID:HIT103095149
  • Cas No:819827-50-4
  • Common Name:CB7993113
  • IUPAC:2-{[2-(5-bromofuran-2-yl)-4-oxo-4H-chromen-3-yl]oxy}acetamide
    IUPAC:2-{[2-(5-bromofuran-2-yl)-4-oxo-4H-chromen-3-yl]oxy}acetamide
  • InChIKey:KGIGMCONNWRUGX-UHFFFAOYSA-N
  • Molecular Formula:C15H10BrNO5
  • Molecular Weight:364.151
  • Hydrogen Bond Donor (HBD):2
  • Hydrogen Bond Acceptor (HBA):5
  • LogP:1.811
  • SMILES:NC(=O)COc1c(oc2ccccc2c1=O)-c1ccc(Br)o1
    SMILES:NC(=O)COc1c(oc2ccccc2c1=O)-c1ccc(Br)o1
  • CB7993113 is a potent AHR antagonist with an IC50 of 0.33 μM, directly binding the AHR protein and blocking its nuclear translocation. It inhibits polycyclic aromatic hydrocarbon (PAH)- and TCDD-induced reporter activity by 75% and 90%, respectively [1].
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