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canSAR1151409
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NAMES
    SMILES
    CCOC(Nc1c([S+]([O-])CC)c(C#N)nn1-c1c(Cl)cc(C(F)(F)F)cc1Cl)C(Cl)(Cl)Cl
    InChI
    InChI=1S/C17H14Cl5F3N4O2S/c1-3-31-15(16(20,21)22)27-14-13(32(30)4-2)11(7-26)28-29(14)12-9(18)5-8(6-10(12)19)17(23,24)25/h5-6,15,27H,3-4H2,1-2H3
    MOLECULAR FORMULA
    C17H14Cl5F3N4O2S
    CROSS REFERENCES
    1151409 logo

    canSAR1151409

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 569.92
    AlogP 6.34
    HBond donors 1
    HBond acceptors 6
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1151409.