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canSAR1635815
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NAMES
    SMILES
    Cn1cc(-c2ccc(F)c(C(F)(F)F)c2)nc1C1CCN(c2ncnc(N)c2Br)CC1
    InChI
    InChI=1S/C20H19BrF4N6/c1-30-9-15(12-2-3-14(22)13(8-12)20(23,24)25)29-18(30)11-4-6-31(7-5-11)19-16(21)17(26)27-10-28-19/h2-3,8-11H,4-7H2,1H3,(H2,26,27,28)
    MOLECULAR FORMULA
    C20H19BrF4N6
    CROSS REFERENCES
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    canSAR1635815

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 498.08
    AlogP 4.76
    HBond donors 2
    HBond acceptors 6
    Atoms 50
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1635815.