canSAR1746894
FEATURES
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NAMES
    SMILES
    CC(C)C(=O)NC(=S)N1CCc2ccccc21
    InChI
    InChI=1S/C13H16N2OS/c1-9(2)12(16)14-13(17)15-8-7-10-5-3-4-6-11(10)15/h3-6,9H,7-8H2,1-2H3,(H,14,16,17)
    MOLECULAR FORMULA
    C13H16N2OS
    CROSS REFERENCES
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    canSAR1746894
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight248.10
    AlogP2.11
    HBond donors1
    HBond acceptors3
    Atoms33
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746894.