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canSAR1142485
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NAMES
    SMILES
    CC(=O)N1N=C(c2ccc(F)cc2)CC1c1cn(-c2ccccc2)nc1-c1ccc(Br)cc1
    InChI
    InChI=1S/C26H20BrFN4O/c1-17(33)32-25(15-24(29-32)18-9-13-21(28)14-10-18)23-16-31(22-5-3-2-4-6-22)30-26(23)19-7-11-20(27)12-8-19/h2-14,16,25H,15H2,1H3
    MOLECULAR FORMULA
    C26H20BrFN4O
    CROSS REFERENCES
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    canSAR1142485

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.08
    AlogP 6.14
    HBond donors 0
    HBond acceptors 5
    Atoms 53
    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 canSAR1142485.