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canSAR1637619
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NAMES
    SMILES
    O=C(Nc1ccc(Br)cc1)c1ccc(F)c(S(=O)(=O)N2CCCc3ccccc32)c1
    InChI
    InChI=1S/C22H18BrFN2O3S/c23-17-8-10-18(11-9-17)25-22(27)16-7-12-19(24)21(14-16)30(28,29)26-13-3-5-15-4-1-2-6-20(15)26/h1-2,4,6-12,14H,3,5,13H2,(H,25,27)
    MOLECULAR FORMULA
    C22H18BrFN2O3S
    CROSS REFERENCES
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    canSAR1637619

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.02
    AlogP 4.98
    HBond donors 1
    HBond acceptors 5
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1637619.