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canSAR1768329
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NAMES
    SMILES
    COc1ccccc1N1CCN(CCCCNC(=O)/N=N/c2cc(F)c(F)c(F)c2)CC1
    InChI
    InChI=1S/C22H26F3N5O2/c1-32-20-7-3-2-6-19(20)30-12-10-29(11-13-30)9-5-4-8-26-22(31)28-27-16-14-17(23)21(25)18(24)15-16/h2-3,6-7,14-15H,4-5,8-13H2,1H3,(H,26,31)/b28-27+
    MOLECULAR FORMULA
    C22H26F3N5O2
    CROSS REFERENCES
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    canSAR1768329

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 449.20
    AlogP 4.51
    HBond donors 1
    HBond acceptors 7
    Atoms 58
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1768329.