canSAR593991
FEATURES
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NAMES
    SMILES
    Cn1cc(Br)c(-c2cccc(Nc3ccnc4cc(-c5nccs5)ccc34)c2)n1
    InChI
    InChI=1S/C22H16BrN5S/c1-28-13-18(23)21(27-28)14-3-2-4-16(11-14)26-19-7-8-24-20-12-15(5-6-17(19)20)22-25-9-10-29-22/h2-13H,1H3,(H,24,26)
    MOLECULAR FORMULA
    C22H16BrN5S
    CROSS REFERENCES
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    canSAR593991
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight461.03
    AlogP6.26
    HBond donors1
    HBond acceptors5
    Atoms45
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR593991.