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canSAR67288
FEATURES
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NAMES
    SMILES
    C[C@]1(C(=O)O)CCc2ccc(OCCCOc3ccc(Oc4ccccc4)cc3Cl)cc2O1
    InChI
    InChI=1S/C26H25ClO6/c1-26(25(28)29)13-12-18-8-9-20(17-24(18)33-26)30-14-5-15-31-23-11-10-21(16-22(23)27)32-19-6-3-2-4-7-19/h2-4,6-11,16-17H,5,12-15H2,1H3,(H,28,29)/t26-/m1/s1
    MOLECULAR FORMULA
    C26H25ClO6
    CROSS REFERENCES
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    canSAR67288

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.13
    AlogP 6.15
    HBond donors 1
    HBond acceptors 6
    Atoms 58
    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 canSAR67288.