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canSAR2050077
FEATURES
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NAMES
    SMILES
    CCCc1cc(O)cc(O)c1Oc1c(Cl)c(O)c(Cl)c2c1C(=O)O[C@@H]2CC
    InChI
    InChI=1S/C19H18Cl2O6/c1-3-5-8-6-9(22)7-10(23)17(8)27-18-13-12(11(4-2)26-19(13)25)14(20)16(24)15(18)21/h6-7,11,22-24H,3-5H2,1-2H3/t11-/m1/s1
    MOLECULAR FORMULA
    C19H18Cl2O6
    CROSS REFERENCES
    2050077 logo

    canSAR2050077

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.05
    AlogP 5.48
    HBond donors 3
    HBond acceptors 6
    Atoms 45
    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 canSAR2050077.