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canSAR1768292
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NAMES
    SMILES
    COc1cc(/C=N/NC(=O)C[n+]2ccccc2)cc(OC)c1OC(C)=O
    InChI
    InChI=1S/C18H19N3O5/c1-13(22)26-18-15(24-2)9-14(10-16(18)25-3)11-19-20-17(23)12-21-7-5-4-6-8-21/h4-11H,12H2,1-3H3/p+1/b19-11+
    MOLECULAR FORMULA
    C18H20N3O5+
    CROSS REFERENCES
    1768292 logo

    canSAR1768292

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 358.14
    AlogP 1.07
    HBond donors 1
    HBond acceptors 8
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1768292.