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canSAR467682
FEATURES
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NAMES
    SMILES
    COC1C(C)OC(OC2CC(C)(O)Cc3cc4c(c(O)c32)C(=O)c2c(O)cc3c(c2C4=O)OC2OC3(C)C(OC(C)=O)C(N(C)C)C2OC(C)=O)C(OC)C1(C)OC
    InChI
    InChI=1S/C41H51NO16/c1-16-34(50-9)41(6,52-11)36(51-10)38(53-16)56-23-15-39(4,49)14-19-12-20-25(30(47)24(19)23)31(48)26-22(45)13-21-32(27(26)29(20)46)57-37-33(54-17(2)43)28(42(7)8)35(55-18(3)44)40(21,5)58-37/h12-13,16,23,28,33-38,45,47,49H,14-15H2,1-11H3
    MOLECULAR FORMULA
    C41H51NO16
    CROSS REFERENCES
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    canSAR467682

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 813.32
    AlogP 2.57
    HBond donors 3
    HBond acceptors 17
    Atoms 109
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR467682.