canSAR1602643
FEATURES
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NAMES
    SMILES
    CC1CCc2c(sc(NC(=O)COc3ccccc3C(C)(C)C)c2C#N)C1
    InChI
    InChI=1S/C22H26N2O2S/c1-14-9-10-15-16(12-23)21(27-19(15)11-14)24-20(25)13-26-18-8-6-5-7-17(18)22(2,3)4/h5-8,14H,9-11,13H2,1-4H3,(H,24,25)
    MOLECULAR FORMULA
    C22H26N2O2S
    CROSS REFERENCES
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    canSAR1602643
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight382.17
    AlogP5.06
    HBond donors1
    HBond acceptors4
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1602643.