canSAR1774705
FEATURES
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NAMES
    SMILES
    CC(C(=O)c1ccc(Br)cc1)[n+]1cccc2ccccc21
    InChI
    InChI=1S/C18H15BrNO/c1-13(18(21)15-8-10-16(19)11-9-15)20-12-4-6-14-5-2-3-7-17(14)20/h2-13H,1H3/q+1
    MOLECULAR FORMULA
    C18H15BrNO+
    CROSS REFERENCES
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    canSAR1774705
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight340.03
    AlogP4.33
    HBond donors0
    HBond acceptors2
    Atoms36
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1774705.