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canSAR1094102
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NAMES
    SMILES
    O=C(/C=C/C(=O)c1ccc(Br)cc1)Nc1ccccc1
    InChI
    InChI=1S/C16H12BrNO2/c17-13-8-6-12(7-9-13)15(19)10-11-16(20)18-14-4-2-1-3-5-14/h1-11H,(H,18,20)/b11-10+
    MOLECULAR FORMULA
    C16H12BrNO2
    CROSS REFERENCES
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    canSAR1094102

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 329.01
    AlogP 3.83
    HBond donors 1
    HBond acceptors 3
    Atoms 32
    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 canSAR1094102.