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canSAR465394
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NAMES
    SMILES
    OC(CN1CCN(Cc2cccc(I)c2)CC1)(Cn1cncn1)c1ccc(F)cc1F
    InChI
    InChI=1S/C22H24F2IN5O/c23-18-4-5-20(21(24)11-18)22(31,14-30-16-26-15-27-30)13-29-8-6-28(7-9-29)12-17-2-1-3-19(25)10-17/h1-5,10-11,15-16,31H,6-9,12-14H2
    MOLECULAR FORMULA
    C22H24F2IN5O
    CROSS REFERENCES
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    canSAR465394

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 539.10
    AlogP 2.87
    HBond donors 1
    HBond acceptors 6
    Atoms 55
    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 canSAR465394.