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canSAR1523416
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NAMES
    SMILES
    CCOc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCC(=O)Nc3ccccc3)n2)cc1
    InChI
    InChI=1S/C23H18F3N3O2S/c1-2-31-17-10-8-15(9-11-17)20-12-19(23(24,25)26)18(13-27)22(29-20)32-14-21(30)28-16-6-4-3-5-7-16/h3-12H,2,14H2,1H3,(H,28,30)
    MOLECULAR FORMULA
    C23H18F3N3O2S
    CROSS REFERENCES
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    canSAR1523416

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.11
    AlogP 5.77
    HBond donors 1
    HBond acceptors 5
    Atoms 50
    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 canSAR1523416.