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canSAR1406846
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NAMES
    SMILES
    CN(C)c1ccc(C(CNS(=O)(=O)c2ccc(Br)cc2)N2CCCC2)cc1
    InChI
    InChI=1S/C20H26BrN3O2S/c1-23(2)18-9-5-16(6-10-18)20(24-13-3-4-14-24)15-22-27(25,26)19-11-7-17(21)8-12-19/h5-12,20,22H,3-4,13-15H2,1-2H3
    MOLECULAR FORMULA
    C20H26BrN3O2S
    CROSS REFERENCES
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    canSAR1406846

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.09
    AlogP 3.63
    HBond donors 1
    HBond acceptors 5
    Atoms 53
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1406846.