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canSAR1208665
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NAMES
    SMILES
    CCC(=O)OCc1cn(CCCOc2ccc(/C=N/NC(=O)c3ccncc3)cc2)nn1
    InChI
    InChI=1S/C22H24N6O4/c1-2-21(29)32-16-19-15-28(27-25-19)12-3-13-31-20-6-4-17(5-7-20)14-24-26-22(30)18-8-10-23-11-9-18/h4-11,14-15H,2-3,12-13,16H2,1H3,(H,26,30)/b24-14+
    MOLECULAR FORMULA
    C22H24N6O4
    CROSS REFERENCES
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    canSAR1208665

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.19
    AlogP 2.36
    HBond donors 1
    HBond acceptors 10
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1208665.