canSAR2098972
FEATURES
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NAMES
    SMILES
    CC1=C(C(=O)OC(C)C)C(c2ccco2)n2ncnc2N1
    InChI
    InChI=1S/C14H16N4O3/c1-8(2)21-13(19)11-9(3)17-14-15-7-16-18(14)12(11)10-5-4-6-20-10/h4-8,12H,1-3H3,(H,15,16,17)
    MOLECULAR FORMULA
    C14H16N4O3
    CROSS REFERENCES
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    canSAR2098972
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight288.12
    AlogP2.11
    HBond donors1
    HBond acceptors7
    Atoms37
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2098972.