canSAR936045
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCc1ccc(S(=O)(=O)Nc2nnc(C)s2)cc1
    InChI
    InChI=1S/C21H33N3O2S2/c1-3-4-5-6-7-8-9-10-11-12-13-19-14-16-20(17-15-19)28(25,26)24-21-23-22-18(2)27-21/h14-17H,3-13H2,1-2H3,(H,23,24)
    MOLECULAR FORMULA
    C21H33N3O2S2
    CROSS REFERENCES
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    canSAR936045
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight423.20
    AlogP6.11
    HBond donors1
    HBond acceptors5
    Atoms61
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR936045.