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canSAR1119162
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NAMES
    SMILES
    O=C(CCOc1ccccc1)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1
    InChI
    InChI=1S/C23H19BrN4O2/c24-16-5-4-6-17(13-16)28-23-20-14-18(9-10-21(20)25-15-26-23)27-22(29)11-12-30-19-7-2-1-3-8-19/h1-10,13-15H,11-12H2,(H,27,29)(H,25,26,28)
    MOLECULAR FORMULA
    C23H19BrN4O2
    CROSS REFERENCES
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    canSAR1119162

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.07
    AlogP 5.54
    HBond donors 2
    HBond acceptors 6
    Atoms 49
    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 canSAR1119162.