canSAR1584106
FEATURES
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NAMES
    SMILES
    CC(C)Nc1nc(-c2ccccc2CO)c2sccc2n1
    InChI
    InChI=1S/C16H17N3OS/c1-10(2)17-16-18-13-7-8-21-15(13)14(19-16)12-6-4-3-5-11(12)9-20/h3-8,10,20H,9H2,1-2H3,(H,17,18,19)
    MOLECULAR FORMULA
    C16H17N3OS
    CROSS REFERENCES
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    canSAR1584106
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight299.11
    AlogP3.67
    HBond donors2
    HBond acceptors4
    Atoms38
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1584106.