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canSAR559245
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NAMES
    SMILES
    Cc1cc(C)c(-n2cc[n+](CC(=O)c3ccc(Br)cc3)c2)c(C)c1
    InChI
    InChI=1S/C20H20BrN2O/c1-14-10-15(2)20(16(3)11-14)23-9-8-22(13-23)12-19(24)17-4-6-18(21)7-5-17/h4-11,13H,12H2,1-3H3/q+1
    MOLECULAR FORMULA
    C20H20BrN2O+
    CROSS REFERENCES
    559245 logo

    canSAR559245

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.08
    AlogP 4.34
    HBond donors 0
    HBond acceptors 3
    Atoms 44
    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 canSAR559245.