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canSAR143383
FEATURES
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NAMES
    SMILES
    O=C(O[C@H]1Cc2c(O)cc(O)cc2O[C@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1
    InChI
    InChI=1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21-/m0/s1
    MOLECULAR FORMULA
    C22H18O11
    CROSS REFERENCES
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    canSAR143383

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.08
    AlogP 2.23
    HBond donors 8
    HBond acceptors 11
    Atoms 51
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR143383.