canSAR823985
FEATURES
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NAMES
    SMILES
    CCNC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CNCC2CC2C(=O)OCC)[C@H]2O[C@H](/C=C/c3ccccc3)O[C@H]21
    InChI
    InChI=1S/C29H35N7O6/c1-3-31-29(38)35-25-22-26(33-15-32-25)36(16-34-22)27-24-23(41-21(42-24)11-10-17-8-6-5-7-9-17)20(40-27)14-30-13-18-12-19(18)28(37)39-4-2/h5-11,15-16,18-21,23-24,27,30H,3-4,12-14H2,1-2H3,(H2,31,32,33,35,38)/b11-10+/t18?,19?,20-,21+,23-,24-,27-/m1/s1
    MOLECULAR FORMULA
    C29H35N7O6
    CROSS REFERENCES
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    canSAR823985
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight577.26
    AlogP2.48
    HBond donors3
    HBond acceptors13
    Atoms77
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823985.