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canSAR668165
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NAMES
    SMILES
    CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccc(OCc2ccc(Br)cc2)cc1
    InChI
    InChI=1S/C26H28BrNO5/c1-5-31-25(29)22-16(3)28-17(4)23(26(30)32-6-2)24(22)19-9-13-21(14-10-19)33-15-18-7-11-20(27)12-8-18/h7-14,24,28H,5-6,15H2,1-4H3
    MOLECULAR FORMULA
    C26H28BrNO5
    CROSS REFERENCES
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    canSAR668165

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 513.12
    AlogP 5.39
    HBond donors 1
    HBond acceptors 6
    Atoms 61
    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 canSAR668165.