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canSAR50017
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NAMES
    SMILES
    COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O
    InChI
    InChI=1S/C12H11NO5S/c1-17-7-3-6(4-8(18-2)10(7)14)5-9-11(15)13-12(16)19-9/h3-5,14H,1-2H3,(H,13,15,16)/b9-5+
    MOLECULAR FORMULA
    C12H11NO5S
    CROSS REFERENCES
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    canSAR50017

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 281.04
    AlogP 1.73
    HBond donors 2
    HBond acceptors 6
    Atoms 30
    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 canSAR50017.