canSAR1706055
FEATURES
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NAMES
    SMILES
    C=CCOc1c(Br)cc(/C=N\n2nnnc2N)cc1OC
    InChI
    InChI=1S/C12H13BrN6O2/c1-3-4-21-11-9(13)5-8(6-10(11)20-2)7-15-19-12(14)16-17-18-19/h3,5-7H,1,4H2,2H3,(H2,14,16,18)/b15-7-
    MOLECULAR FORMULA
    C12H13BrN6O2
    CROSS REFERENCES
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    canSAR1706055
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight352.03
    AlogP1.47
    HBond donors2
    HBond acceptors8
    Atoms34
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1706055.