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canSAR1445061
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NAMES
    SMILES
    CN(C)c1ccc(Nc2ncnc3ccc(Br)cc23)cc1
    InChI
    InChI=1S/C16H15BrN4/c1-21(2)13-6-4-12(5-7-13)20-16-14-9-11(17)3-8-15(14)18-10-19-16/h3-10H,1-2H3,(H,18,19,20)
    MOLECULAR FORMULA
    C16H15BrN4
    CROSS REFERENCES
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    canSAR1445061

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.05
    AlogP 4.20
    HBond donors 1
    HBond acceptors 4
    Atoms 36
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1445061.