canSAR1648863
FEATURES
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NAMES
    SMILES
    COc1cc(C=NNC(=O)CC2(C)OCCO2)cc(Br)c1O
    InChI
    InChI=1S/C14H17BrN2O5/c1-14(21-3-4-22-14)7-12(18)17-16-8-9-5-10(15)13(19)11(6-9)20-2/h5-6,8,19H,3-4,7H2,1-2H3,(H,17,18)
    MOLECULAR FORMULA
    C14H17BrN2O5
    CROSS REFERENCES
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    canSAR1648863
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight372.03
    AlogP1.77
    HBond donors2
    HBond acceptors7
    Atoms39
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1648863.