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canSAR1126921
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NAMES
    SMILES
    O=C1CCc2ccc(OCc3cccc(Br)c3)cc2N1
    InChI
    InChI=1S/C16H14BrNO2/c17-13-3-1-2-11(8-13)10-20-14-6-4-12-5-7-16(19)18-15(12)9-14/h1-4,6,8-9H,5,7,10H2,(H,18,19)
    MOLECULAR FORMULA
    C16H14BrNO2
    CROSS REFERENCES
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    canSAR1126921

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.02
    AlogP 3.91
    HBond donors 1
    HBond acceptors 3
    Atoms 34
    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 canSAR1126921.