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canSAR561244
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NAMES
    SMILES
    Fc1ccccc1-[n+]1nc(-c2ccc(OCc3ccccc3)cc2)nn1-c1ccccc1
    InChI
    InChI=1S/C26H20FN4O/c27-24-13-7-8-14-25(24)31-29-26(28-30(31)22-11-5-2-6-12-22)21-15-17-23(18-16-21)32-19-20-9-3-1-4-10-20/h1-18H,19H2/q+1
    MOLECULAR FORMULA
    C26H20FN4O+
    CROSS REFERENCES
    561244 logo

    canSAR561244

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.16
    AlogP 4.93
    HBond donors 0
    HBond acceptors 5
    Atoms 52
    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 canSAR561244.