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canSAR1651002
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NAMES
    SMILES
    COC(=O)CCc1c(C)c(C(=O)c2ccco2)c2ccccn12
    InChI
    InChI=1S/C18H17NO4/c1-12-13(8-9-16(20)22-2)19-10-4-3-6-14(19)17(12)18(21)15-7-5-11-23-15/h3-7,10-11H,8-9H2,1-2H3
    MOLECULAR FORMULA
    C18H17NO4
    CROSS REFERENCES
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    canSAR1651002

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 311.12
    AlogP 3.18
    HBond donors 0
    HBond acceptors 5
    Atoms 40
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1651002.