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canSAR1829721
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NAMES
    SMILES
    CC(=O)NC(CCS(C)(=O)=O)C(=O)Nc1ccc2c(c1)OCO2
    InChI
    InChI=1S/C14H18N2O6S/c1-9(17)15-11(5-6-23(2,19)20)14(18)16-10-3-4-12-13(7-10)22-8-21-12/h3-4,7,11H,5-6,8H2,1-2H3,(H,15,17)(H,16,18)
    MOLECULAR FORMULA
    C14H18N2O6S
    CROSS REFERENCES
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    canSAR1829721

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.09
    AlogP 0.29
    HBond donors 2
    HBond acceptors 8
    Atoms 41
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1829721.