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canSAR2017161
FEATURES
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NAMES
    SMILES
    COc1cc2c(C)c(CCC(=O)NCCO)c(=O)oc2c(C=O)c1O
    InChI
    InChI=1S/C17H19NO7/c1-9-10(3-4-14(21)18-5-6-19)17(23)25-16-11(9)7-13(24-2)15(22)12(16)8-20/h7-8,19,22H,3-6H2,1-2H3,(H,18,21)
    MOLECULAR FORMULA
    C17H19NO7
    CROSS REFERENCES
    2017161 logo

    canSAR2017161

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 349.12
    AlogP 0.67
    HBond donors 3
    HBond acceptors 8
    Atoms 44
    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 canSAR2017161.