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canSAR1726273
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NAMES
    SMILES
    COC1O[C@H](CNC(=O)/C=C/c2ccccc2)[C@@H](O)C(O)[C@@H]1O
    InChI
    InChI=1S/C16H21NO6/c1-22-16-15(21)14(20)13(19)11(23-16)9-17-12(18)8-7-10-5-3-2-4-6-10/h2-8,11,13-16,19-21H,9H2,1H3,(H,17,18)/b8-7+/t11-,13-,14?,15+,16?/m1/s1
    MOLECULAR FORMULA
    C16H21NO6
    CROSS REFERENCES
    1726273 logo

    canSAR1726273

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 323.14
    AlogP -0.73
    HBond donors 4
    HBond acceptors 7
    Atoms 44
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1726273.