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canSAR1433903
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NAMES
    SMILES
    CC(=O)N(O)c1ccc(/C=C/c2ccc(Br)cc2)cc1
    InChI
    InChI=1S/C16H14BrNO2/c1-12(19)18(20)16-10-6-14(7-11-16)3-2-13-4-8-15(17)9-5-13/h2-11,20H,1H3/b3-2+
    MOLECULAR FORMULA
    C16H14BrNO2
    CROSS REFERENCES
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    canSAR1433903

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.02
    AlogP 4.36
    HBond donors 1
    HBond acceptors 3
    Atoms 34
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1433903.