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canSAR1120159
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NAMES
    SMILES
    Cc1cc(Oc2ccc(OCc3ccccc3)cc2)nc(Nc2ccc(C#N)cc2)n1
    InChI
    InChI=1S/C25H20N4O2/c1-18-15-24(29-25(27-18)28-21-9-7-19(16-26)8-10-21)31-23-13-11-22(12-14-23)30-17-20-5-3-2-4-6-20/h2-15H,17H2,1H3,(H,27,28,29)
    MOLECULAR FORMULA
    C25H20N4O2
    CROSS REFERENCES
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    canSAR1120159

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 408.16
    AlogP 5.77
    HBond donors 1
    HBond acceptors 6
    Atoms 51
    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 canSAR1120159.