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canSAR1124445
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NAMES
    SMILES
    COc1c(/C=C/c2ccc(NS(C)(=O)=O)cc2)cc(-c2cc(F)c[nH]c2=O)cc1C(C)(C)C
    InChI
    InChI=1S/C25H27FN2O4S/c1-25(2,3)22-13-18(21-14-19(26)15-27-24(21)29)12-17(23(22)32-4)9-6-16-7-10-20(11-8-16)28-33(5,30)31/h6-15,28H,1-5H3,(H,27,29)/b9-6+
    MOLECULAR FORMULA
    C25H27FN2O4S
    CROSS REFERENCES
    1124445 logo

    canSAR1124445

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.17
    AlogP 5.03
    HBond donors 2
    HBond acceptors 6
    Atoms 60
    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 canSAR1124445.