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canSAR83741
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NAMES
    SMILES
    Cc1c(Br)c(=O)n(C2CCCC2)c2nc(Nc3ccc(N4CCN(C)CC4)cn3)ncc12
    InChI
    InChI=1S/C23H28BrN7O/c1-15-18-14-26-23(28-21(18)31(22(32)20(15)24)16-5-3-4-6-16)27-19-8-7-17(13-25-19)30-11-9-29(2)10-12-30/h7-8,13-14,16H,3-6,9-12H2,1-2H3,(H,25,26,27,28)
    MOLECULAR FORMULA
    C23H28BrN7O
    CROSS REFERENCES
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    canSAR83741

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 497.15
    AlogP 3.87
    HBond donors 1
    HBond acceptors 8
    Atoms 60
    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 canSAR83741.