canSAR2095695
FEATURES
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NAMES
    SMILES
    CC(C)n1ncc2ccc(C(=O)Nc3nnc(C4CC4)s3)cc21
    InChI
    InChI=1S/C16H17N5OS/c1-9(2)21-13-7-11(5-6-12(13)8-17-21)14(22)18-16-20-19-15(23-16)10-3-4-10/h5-10H,3-4H2,1-2H3,(H,18,20,22)
    MOLECULAR FORMULA
    C16H17N5OS
    CROSS REFERENCES
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    canSAR2095695
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight327.12
    AlogP3.60
    HBond donors1
    HBond acceptors6
    Atoms40
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095695.