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canSAR498626
FEATURES
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NAMES
    SMILES
    CC(=O)C1=C(O)C(C)=C(O)C(C)(C)C1=O
    InChI
    InChI=1S/C11H14O4/c1-5-8(13)7(6(2)12)10(15)11(3,4)9(5)14/h13-14H,1-4H3
    MOLECULAR FORMULA
    C11H14O4
    CROSS REFERENCES
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    canSAR498626

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 210.09
    AlogP 1.83
    HBond donors 2
    HBond acceptors 4
    Atoms 29
    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 canSAR498626.