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canSAR1687051
FEATURES
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NAMES
    SMILES
    Cc1cc(S(=O)(=O)NC(C)C)ccc1OCC(=O)Nc1ccc2c(c1)OCCO2
    InChI
    InChI=1S/C20H24N2O6S/c1-13(2)22-29(24,25)16-5-7-17(14(3)10-16)28-12-20(23)21-15-4-6-18-19(11-15)27-9-8-26-18/h4-7,10-11,13,22H,8-9,12H2,1-3H3,(H,21,23)
    MOLECULAR FORMULA
    C20H24N2O6S
    CROSS REFERENCES
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    canSAR1687051

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.14
    AlogP 2.47
    HBond donors 2
    HBond acceptors 8
    Atoms 53
    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 canSAR1687051.