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canSAR1973396
FEATURES
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NAMES
    SMILES
    Cc1cc(C)c(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1S(=O)(=O)Nc1ccc(C(=O)O)cc1
    InChI
    InChI=1S/C22H20N2O8S2/c1-13-11-14(2)20(34(31,32)24-18-9-5-16(6-10-18)22(27)28)12-19(13)33(29,30)23-17-7-3-15(4-8-17)21(25)26/h3-12,23-24H,1-2H3,(H,25,26)(H,27,28)
    MOLECULAR FORMULA
    C22H20N2O8S2
    CROSS REFERENCES
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    canSAR1973396

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 504.07
    AlogP 3.30
    HBond donors 4
    HBond acceptors 10
    Atoms 54
    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 canSAR1973396.