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HIT102992453
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HIT102992453
  • HIT ID:HIT102992453
  • Cas No:162359-55-9;162359-56-0
  • Common Name:Fingolimod
  • alias:FTY-720A, FTY-720
  • IUPAC:2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol
    IUPAC:2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol
  • InChIKey:KKGQTZUTZRNORY-UHFFFAOYSA-N
  • Molecular Formula:C19H33NO2
  • Molecular Weight:307.478
  • Hydrogen Bond Donor (HBD):3
  • Hydrogen Bond Acceptor (HBA):3
  • LogP:4.060978
  • SMILES:CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1
    SMILES:CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1
  • Fingolimod (FTY-720A) is an antagonist of sphingosine 1-phosphate (S1P) (IC50 of 0.033 nM in K562 and NK cells).
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