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canSAR649591
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NAMES
    SMILES
    COc1cccc(/C=C2\SC(=S)N(CCC(=O)Nc3cccc4nonc34)C2=O)c1
    InChI
    InChI=1S/C20H16N4O4S2/c1-27-13-5-2-4-12(10-13)11-16-19(26)24(20(29)30-16)9-8-17(25)21-14-6-3-7-15-18(14)23-28-22-15/h2-7,10-11H,8-9H2,1H3,(H,21,25)/b16-11-
    MOLECULAR FORMULA
    C20H16N4O4S2
    CROSS REFERENCES
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    canSAR649591

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.06
    AlogP 3.46
    HBond donors 1
    HBond acceptors 8
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR649591.