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canSAR654572
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NAMES
    SMILES
    CN1CCN(c2cc(NCc3ccc(C(C)(C)C)cc3)nc(N)n2)CC1
    InChI
    InChI=1S/C20H30N6/c1-20(2,3)16-7-5-15(6-8-16)14-22-17-13-18(24-19(21)23-17)26-11-9-25(4)10-12-26/h5-8,13H,9-12,14H2,1-4H3,(H3,21,22,23,24)
    MOLECULAR FORMULA
    C20H30N6
    CROSS REFERENCES
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    canSAR654572

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 354.25
    AlogP 2.72
    HBond donors 3
    HBond acceptors 6
    Atoms 56
    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 canSAR654572.