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canSAR498515
FEATURES
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NAMES
    SMILES
    COc1ccc(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1
    InChI
    InChI=1S/C16H13N3O5S2/c1-24-13-5-7-14(8-6-13)26(22,23)18-16-17-15(10-25-16)11-3-2-4-12(9-11)19(20)21/h2-10H,1H3,(H,17,18)
    MOLECULAR FORMULA
    C16H13N3O5S2
    CROSS REFERENCES
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    canSAR498515

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 391.03
    AlogP 3.53
    HBond donors 1
    HBond acceptors 8
    Atoms 39
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR498515.