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canSAR1406133
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NAMES
    SMILES
    CC1CCc2c(C(=O)Nc3cccc(-c4nn[nH]n4)c3)csc2C1
    InChI
    InChI=1S/C17H17N5OS/c1-10-5-6-13-14(9-24-15(13)7-10)17(23)18-12-4-2-3-11(8-12)16-19-21-22-20-16/h2-4,8-10H,5-7H2,1H3,(H,18,23)(H,19,20,21,22)
    MOLECULAR FORMULA
    C17H17N5OS
    CROSS REFERENCES
    1406133 logo

    canSAR1406133

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 339.12
    AlogP 3.31
    HBond donors 2
    HBond acceptors 6
    Atoms 41
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1406133.