canSAR1087136
FEATURES
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NAMES
    SMILES
    COc1ccc(OC)c(/C=N/NC(=O)c2n[nH]c3c2CCC3)c1
    InChI
    InChI=1S/C16H18N4O3/c1-22-11-6-7-14(23-2)10(8-11)9-17-20-16(21)15-12-4-3-5-13(12)18-19-15/h6-9H,3-5H2,1-2H3,(H,18,19)(H,20,21)/b17-9+
    MOLECULAR FORMULA
    C16H18N4O3
    CROSS REFERENCES
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    canSAR1087136
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight314.14
    AlogP1.68
    HBond donors2
    HBond acceptors7
    Atoms41
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087136.