canSAR385855
FEATURES
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NAMES
    SMILES
    COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(CO)=N/NC(=O)c1ccc(Cl)c(Cl)c1)C[C@@H]3OC1CC(N)C(O)C(C)O1
    InChI
    InChI=1S/C34H33Cl2N3O11/c1-13-28(41)19(37)9-23(49-13)50-21-11-34(47,22(12-40)38-39-33(46)14-6-7-17(35)18(36)8-14)10-16-25(21)32(45)27-26(30(16)43)29(42)15-4-3-5-20(48-2)24(15)31(27)44/h3-8,13,19,21,23,28,40-41,43,45,47H,9-12,37H2,1-2H3,(H,39,46)/b38-22+/t13?,19?,21-,23?,28?,34-/m0/s1
    MOLECULAR FORMULA
    C34H33Cl2N3O11
    CROSS REFERENCES
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    canSAR385855
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight729.15
    AlogP2.52
    HBond donors8
    HBond acceptors14
    Atoms83
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR385855.