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canSAR1128767
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NAMES
    SMILES
    COc1cccc(C(=O)c2cc(C)nn(CC(=O)Nc3ccc(Br)cc3)c2=O)c1
    InChI
    InChI=1S/C21H18BrN3O4/c1-13-10-18(20(27)14-4-3-5-17(11-14)29-2)21(28)25(24-13)12-19(26)23-16-8-6-15(22)7-9-16/h3-11H,12H2,1-2H3,(H,23,26)
    MOLECULAR FORMULA
    C21H18BrN3O4
    CROSS REFERENCES
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    canSAR1128767

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 455.05
    AlogP 3.19
    HBond donors 1
    HBond acceptors 7
    Atoms 47
    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 canSAR1128767.