canSAR1644919
FEATURES
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NAMES
    SMILES
    CC(C)(C(=O)c1ccccc1)/[N+]([O-])=C/c1ccc(Br)cc1
    InChI
    InChI=1S/C17H16BrNO2/c1-17(2,16(20)14-6-4-3-5-7-14)19(21)12-13-8-10-15(18)11-9-13/h3-12H,1-2H3/b19-12-
    MOLECULAR FORMULA
    C17H16BrNO2
    CROSS REFERENCES
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    canSAR1644919
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight345.04
    AlogP4.04
    HBond donors0
    HBond acceptors3
    Atoms37
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1644919.