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canSAR549695
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NAMES
    SMILES
    NCCCOc1c(Br)cc(Br)cc1C/C(=N/O)C(=O)NCCc1ccc(Cl)cc1
    InChI
    InChI=1S/C20H22Br2ClN3O3/c21-15-10-14(19(17(22)12-15)29-9-1-7-24)11-18(26-28)20(27)25-8-6-13-2-4-16(23)5-3-13/h2-5,10,12,28H,1,6-9,11,24H2,(H,25,27)/b26-18-
    MOLECULAR FORMULA
    C20H22Br2ClN3O3
    CROSS REFERENCES
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    canSAR549695

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 544.97
    AlogP 4.32
    HBond donors 4
    HBond acceptors 6
    Atoms 51
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR549695.