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canSAR1143826
FEATURES
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NAMES
    SMILES
    CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccc(-c3ccc(C(=O)O)cc3)cc2C(=O)O)c1
    InChI
    InChI=1S/C25H24N2O7S/c1-3-27(4-2)35(33,34)20-7-5-6-19(14-20)23(28)26-22-13-12-18(15-21(22)25(31)32)16-8-10-17(11-9-16)24(29)30/h5-15H,3-4H2,1-2H3,(H,26,28)(H,29,30)(H,31,32)
    MOLECULAR FORMULA
    C25H24N2O7S
    CROSS REFERENCES
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    canSAR1143826

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.13
    AlogP 4.03
    HBond donors 3
    HBond acceptors 9
    Atoms 59
    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 canSAR1143826.