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canSAR1443319
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NAMES
    SMILES
    O=C(CN1CCN(c2ccc(C(F)(F)F)cn2)CC1)Nc1ccc2c(c1)OCO2
    InChI
    InChI=1S/C19H19F3N4O3/c20-19(21,22)13-1-4-17(23-10-13)26-7-5-25(6-8-26)11-18(27)24-14-2-3-15-16(9-14)29-12-28-15/h1-4,9-10H,5-8,11-12H2,(H,24,27)
    MOLECULAR FORMULA
    C19H19F3N4O3
    CROSS REFERENCES
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    canSAR1443319

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 408.14
    AlogP 2.59
    HBond donors 1
    HBond acceptors 7
    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 canSAR1443319.