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canSAR785564
FEATURES
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NAMES
    SMILES
    CCNC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CNCc2nccs2)[C@H]2O[C@H](/C=C/c3ccccc3)O[C@H]21
    InChI
    InChI=1S/C26H28N8O4S/c1-2-28-26(35)33-23-20-24(31-14-30-23)34(15-32-20)25-22-21(17(36-25)12-27-13-18-29-10-11-39-18)37-19(38-22)9-8-16-6-4-3-5-7-16/h3-11,14-15,17,19,21-22,25,27H,2,12-13H2,1H3,(H2,28,30,31,33,35)/b9-8+/t17-,19+,21-,22-,25-/m1/s1
    MOLECULAR FORMULA
    C26H28N8O4S
    CROSS REFERENCES
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    canSAR785564

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 548.20
    AlogP 2.93
    HBond donors 3
    HBond acceptors 12
    Atoms 67
    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 canSAR785564.