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canSAR22061
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NAMES
    SMILES
    COc1ccc(-c2cc(C#N)c(NNC(=O)C(C)C)[nH]2)cc1
    InChI
    InChI=1S/C16H18N4O2/c1-10(2)16(21)20-19-15-12(9-17)8-14(18-15)11-4-6-13(22-3)7-5-11/h4-8,10,18-19H,1-3H3,(H,20,21)
    MOLECULAR FORMULA
    C16H18N4O2
    CROSS REFERENCES
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    canSAR22061

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 298.14
    AlogP 2.66
    HBond donors 3
    HBond acceptors 6
    Atoms 40
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR22061.