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canSAR1402901
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NAMES
    SMILES
    CC(C)(C)n1nnnc1C(c1cccc(C#N)c1)N1CCN2CCCC2C1
    InChI
    InChI=1S/C20H27N7/c1-20(2,3)27-19(22-23-24-27)18(16-7-4-6-15(12-16)13-21)26-11-10-25-9-5-8-17(25)14-26/h4,6-7,12,17-18H,5,8-11,14H2,1-3H3
    MOLECULAR FORMULA
    C20H27N7
    CROSS REFERENCES
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    canSAR1402901

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 365.23
    AlogP 2.17
    HBond donors 0
    HBond acceptors 7
    Atoms 54
    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 canSAR1402901.