canSAR2096046
FEATURES
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NAMES
    SMILES
    O=C1N=C(Nc2nccs2)S/C1=C1\C(=O)Nc2ccc(Br)cc21
    InChI
    InChI=1S/C14H7BrN4O2S2/c15-6-1-2-8-7(5-6)9(11(20)17-8)10-12(21)18-14(23-10)19-13-16-3-4-22-13/h1-5H,(H,17,20)(H,16,18,19,21)/b10-9-
    MOLECULAR FORMULA
    C14H7BrN4O2S2
    CROSS REFERENCES
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    canSAR2096046
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight405.92
    AlogP3.31
    HBond donors2
    HBond acceptors6
    Atoms30
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096046.