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canSAR1504338
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NAMES
    SMILES
    FC(F)(F)c1cccc(NC(S)=Nc2cccc(N=C(S)Nc3cccc(C(F)(F)F)c3)n2)c1
    InChI
    InChI=1S/C21H15F6N5S2/c22-20(23,24)12-4-1-6-14(10-12)28-18(33)31-16-8-3-9-17(30-16)32-19(34)29-15-7-2-5-13(11-15)21(25,26)27/h1-11H,(H4,28,29,30,31,32,33,34)
    MOLECULAR FORMULA
    C21H15F6N5S2
    CROSS REFERENCES
    1504338 logo

    canSAR1504338

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 515.07
    AlogP 7.18
    HBond donors 2
    HBond acceptors 5
    Atoms 49
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1504338.