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canSAR1765958
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NAMES
    SMILES
    CCOC(=O)C(C#N)=Cc1cccc(C)c1
    InChI
    InChI=1S/C13H13NO2/c1-3-16-13(15)12(9-14)8-11-6-4-5-10(2)7-11/h4-8H,3H2,1-2H3
    MOLECULAR FORMULA
    C13H13NO2
    CROSS REFERENCES
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    canSAR1765958

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 215.09
    AlogP 2.47
    HBond donors 0
    HBond acceptors 3
    Atoms 29
    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 canSAR1765958.