canSAR1587045
FEATURES
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NAMES
    SMILES
    CNc1nc2sc3c(c2c(=O)n1C)CC(C)(C)SC3
    InChI
    InChI=1S/C13H17N3OS2/c1-13(2)5-7-8(6-18-13)19-10-9(7)11(17)16(4)12(14-3)15-10/h5-6H2,1-4H3,(H,14,15)
    MOLECULAR FORMULA
    C13H17N3OS2
    CROSS REFERENCES
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    canSAR1587045
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight295.08
    AlogP2.60
    HBond donors1
    HBond acceptors4
    Atoms36
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1587045.