canSAR2168600
FEATURES
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NAMES
    SMILES
    CCS(=O)(=O)c1ccc(Cl)cc1CNC(=O)c1cc(Br)c(CN2CCNCC2)c(OC(F)(F)F)c1
    InChI
    InChI=1S/C22H24BrClF3N3O4S/c1-2-35(32,33)20-4-3-16(24)9-15(20)12-29-21(31)14-10-18(23)17(13-30-7-5-28-6-8-30)19(11-14)34-22(25,26)27/h3-4,9-11,28H,2,5-8,12-13H2,1H3,(H,29,31)
    MOLECULAR FORMULA
    C22H24BrClF3N3O4S
    CROSS REFERENCES
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    canSAR2168600
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight597.03
    AlogP4.13
    HBond donors2
    HBond acceptors7
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2168600.