canSAR1932127
FEATURES
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NAMES
    SMILES
    Cc1c(C(=O)OC(C)C)[nH]c2c1C(=O)CCC2
    InChI
    InChI=1S/C13H17NO3/c1-7(2)17-13(16)12-8(3)11-9(14-12)5-4-6-10(11)15/h7,14H,4-6H2,1-3H3
    MOLECULAR FORMULA
    C13H17NO3
    CROSS REFERENCES
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    canSAR1932127
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight235.12
    AlogP2.41
    HBond donors1
    HBond acceptors4
    Atoms34
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932127.