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canSAR1859447
FEATURES
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NAMES
    SMILES
    CC(C)(CNC(=O)c1cccc(NS(=O)(=O)c2ccc(Br)cc2)c1)N1CCOCC1
    InChI
    InChI=1S/C21H26BrN3O4S/c1-21(2,25-10-12-29-13-11-25)15-23-20(26)16-4-3-5-18(14-16)24-30(27,28)19-8-6-17(22)7-9-19/h3-9,14,24H,10-13,15H2,1-2H3,(H,23,26)
    MOLECULAR FORMULA
    C21H26BrN3O4S
    CROSS REFERENCES
    1859447 logo

    canSAR1859447

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 495.08
    AlogP 3.09
    HBond donors 2
    HBond acceptors 7
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1859447.