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canSAR1522849
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NAMES
    SMILES
    Cc1ccc2nc(SCC(=O)Nc3ccc(Br)cc3)nc(=O)n2c1
    InChI
    InChI=1S/C16H13BrN4O2S/c1-10-2-7-13-19-15(20-16(23)21(13)8-10)24-9-14(22)18-12-5-3-11(17)4-6-12/h2-8H,9H2,1H3,(H,18,22)
    MOLECULAR FORMULA
    C16H13BrN4O2S
    CROSS REFERENCES
    1522849 logo

    canSAR1522849

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.99
    AlogP 2.89
    HBond donors 1
    HBond acceptors 6
    Atoms 37
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1522849.