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canSAR201668
FEATURES
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NAMES
    SMILES
    COC1=C(C)C(=O)c2c(c(CO)c(C)n2CCN2CCOCC2)C1=O
    InChI
    InChI=1S/C18H24N2O5/c1-11-16(22)15-14(17(23)18(11)24-3)13(10-21)12(2)20(15)5-4-19-6-8-25-9-7-19/h21H,4-10H2,1-3H3
    MOLECULAR FORMULA
    C18H24N2O5
    CROSS REFERENCES
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    canSAR201668

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.17
    AlogP 0.92
    HBond donors 1
    HBond acceptors 7
    Atoms 49
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR201668.