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canSAR1636467
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NAMES
    SMILES
    COc1ccccc1N1CCN(CCc2cn(-c3ccn4ncc(C=O)c4c3)nn2)CC1
    InChI
    InChI=1S/C23H25N7O2/c1-32-23-5-3-2-4-21(23)28-12-10-27(11-13-28)8-6-19-16-30(26-25-19)20-7-9-29-22(14-20)18(17-31)15-24-29/h2-5,7,9,14-17H,6,8,10-13H2,1H3
    MOLECULAR FORMULA
    C23H25N7O2
    CROSS REFERENCES
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    canSAR1636467

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.21
    AlogP 2.10
    HBond donors 0
    HBond acceptors 9
    Atoms 57
    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 canSAR1636467.