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canSAR149821
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NAMES
    SMILES
    CCCCc1nc(Cl)c(CC(=O)OC)n1Cc1ccc(NC(=O)c2cc(Br)ccc2NS(=O)(=O)C(F)(F)F)cc1
    InChI
    InChI=1S/C25H25BrClF3N4O5S/c1-3-4-5-21-32-23(27)20(13-22(35)39-2)34(21)14-15-6-9-17(10-7-15)31-24(36)18-12-16(26)8-11-19(18)33-40(37,38)25(28,29)30/h6-12,33H,3-5,13-14H2,1-2H3,(H,31,36)
    MOLECULAR FORMULA
    C25H25BrClF3N4O5S
    CROSS REFERENCES
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    canSAR149821

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 664.04
    AlogP 5.92
    HBond donors 2
    HBond acceptors 9
    Atoms 65
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR149821.