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canSAR114775
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NAMES
    SMILES
    Cc1nc(-c2ccccc2C(F)(F)F)sc1C(=O)NCc1ccc(OC(C)(C)C(=O)O)cc1
    InChI
    InChI=1S/C23H21F3N2O4S/c1-13-18(33-20(28-13)16-6-4-5-7-17(16)23(24,25)26)19(29)27-12-14-8-10-15(11-9-14)32-22(2,3)21(30)31/h4-11H,12H2,1-3H3,(H,27,29)(H,30,31)
    MOLECULAR FORMULA
    C23H21F3N2O4S
    CROSS REFERENCES
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    canSAR114775

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 478.12
    AlogP 5.31
    HBond donors 2
    HBond acceptors 6
    Atoms 54
    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 canSAR114775.