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canSAR846622
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NAMES
    SMILES
    CC1C(C#N)=C(N)OC2=C1C(=O)CC(c1cccc3ccccc13)C2
    InChI
    InChI=1S/C21H18N2O2/c1-12-17(11-22)21(23)25-19-10-14(9-18(24)20(12)19)16-8-4-6-13-5-2-3-7-15(13)16/h2-8,12,14H,9-10,23H2,1H3
    MOLECULAR FORMULA
    C21H18N2O2
    CROSS REFERENCES
    846622 logo

    canSAR846622

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 330.14
    AlogP 3.90
    HBond donors 2
    HBond acceptors 4
    Atoms 43
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR846622.