canSAR1847057
FEATURES
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NAMES
    SMILES
    COc1ccc(C(C)=NOC/C(O)=C(\C#N)c2nc3ccccc3[nH]2)cc1
    InChI
    InChI=1S/C20H18N4O3/c1-13(14-7-9-15(26-2)10-8-14)24-27-12-19(25)16(11-21)20-22-17-5-3-4-6-18(17)23-20/h3-10,25H,12H2,1-2H3,(H,22,23)/b19-16-,24-13?
    MOLECULAR FORMULA
    C20H18N4O3
    CROSS REFERENCES
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    canSAR1847057
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight362.14
    AlogP3.80
    HBond donors2
    HBond acceptors7
    Atoms45
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1847057.