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HIT100678218
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HIT100678218
  • HIT ID:HIT100678218
  • Cas No:103577-40-8
  • Common Name:Lansoprazole sulfide
  • alias:AG-1777, AG1777
  • IUPAC:2-({[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methyl}sulfanyl)-1H-1,3-benzodiazole
    IUPAC:2-({[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methyl}sulfanyl)-1H-1,3-benzodiazole
  • InChIKey:CCHLMSUZHFPSFC-UHFFFAOYSA-N
  • Molecular Formula:C16H14F3N3OS
  • Molecular Weight:353.36
  • Hydrogen Bond Donor (HBD):1
  • Hydrogen Bond Acceptor (HBA):3
  • LogP:4.159756190666667
  • SMILES:Cc1c(OCC(F)(F)F)ccnc1CSc1nc2ccccc2[nH]1
    SMILES:Cc1c(OCC(F)(F)F)ccnc1CSc1nc2ccccc2[nH]1
  • Lansoprazole sulfide (AG-177) is an active metabolite of Lansoprazole with similar activity.Lansoprazole is a proton pump inhibitor and antitubercular agent with an IC50= 0.59 µM against Mycobacterium tuberculosis.
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