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canSAR1088806
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NAMES
    SMILES
    Nc1ccccc1NC(=O)c1ccc(CCNc2nccc(-c3cnc4ncccn34)n2)cc1
    InChI
    InChI=1S/C25H22N8O/c26-19-4-1-2-5-20(19)31-23(34)18-8-6-17(7-9-18)10-13-27-24-28-14-11-21(32-24)22-16-30-25-29-12-3-15-33(22)25/h1-9,11-12,14-16H,10,13,26H2,(H,31,34)(H,27,28,32)
    MOLECULAR FORMULA
    C25H22N8O
    CROSS REFERENCES
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    canSAR1088806

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.19
    AlogP 3.68
    HBond donors 4
    HBond acceptors 9
    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 canSAR1088806.