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canSAR781161
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NAMES
    SMILES
    CCCNC(=O)c1ccc(C)c(Nc2ncnn3cc(C(=O)NCCC)c(C)c23)c1
    InChI
    InChI=1S/C22H28N6O2/c1-5-9-23-21(29)16-8-7-14(3)18(11-16)27-20-19-15(4)17(22(30)24-10-6-2)12-28(19)26-13-25-20/h7-8,11-13H,5-6,9-10H2,1-4H3,(H,23,29)(H,24,30)(H,25,26,27)
    MOLECULAR FORMULA
    C22H28N6O2
    CROSS REFERENCES
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    canSAR781161

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 408.23
    AlogP 3.37
    HBond donors 3
    HBond acceptors 8
    Atoms 58
    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 canSAR781161.