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canSAR1950616
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NAMES
    SMILES
    COc1ccc(Br)cc1C(=O)Nc1cccc(-c2nnc(-c3ccco3)o2)c1
    InChI
    InChI=1S/C20H14BrN3O4/c1-26-16-8-7-13(21)11-15(16)18(25)22-14-5-2-4-12(10-14)19-23-24-20(28-19)17-6-3-9-27-17/h2-11H,1H3,(H,22,25)
    MOLECULAR FORMULA
    C20H14BrN3O4
    CROSS REFERENCES
    1950616 logo

    canSAR1950616

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.02
    AlogP 5.02
    HBond donors 1
    HBond acceptors 7
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1950616.