canSAR81976
FEATURES
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NAMES
    SMILES
    CC(=O)OC[C@H]1O[C@@H](Nc2c(C#N)cnn2-c2ccc(C(=O)O)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
    InChI
    InChI=1S/C25H26N4O11/c1-12(30)36-11-19-20(37-13(2)31)21(38-14(3)32)22(39-15(4)33)24(40-19)28-23-17(9-26)10-27-29(23)18-7-5-16(6-8-18)25(34)35/h5-8,10,19-22,24,28H,11H2,1-4H3,(H,34,35)/t19-,20-,21+,22-,24-/m1/s1
    MOLECULAR FORMULA
    C25H26N4O11
    CROSS REFERENCES
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    canSAR81976
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight558.16
    AlogP0.94
    HBond donors2
    HBond acceptors15
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR81976.