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canSAR102694
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NAMES
    SMILES
    O=C(O)C[C@H](O)C[C@H](O)CCc1c(Cl)cc(Cl)cc1OCc1ccccc1
    InChI
    InChI=1S/C20H22Cl2O5/c21-14-8-18(22)17(7-6-15(23)10-16(24)11-20(25)26)19(9-14)27-12-13-4-2-1-3-5-13/h1-5,8-9,15-16,23-24H,6-7,10-12H2,(H,25,26)/t15-,16-/m1/s1
    MOLECULAR FORMULA
    C20H22Cl2O5
    CROSS REFERENCES
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    canSAR102694

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.08
    AlogP 4.09
    HBond donors 3
    HBond acceptors 5
    Atoms 49
    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 canSAR102694.