canSAR1646937
FEATURES
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NAMES
    SMILES
    COc1ccc(/C=N/NC(=O)c2cccc(Br)c2)cc1CN1CCOCC1
    InChI
    InChI=1S/C20H22BrN3O3/c1-26-19-6-5-15(11-17(19)14-24-7-9-27-10-8-24)13-22-23-20(25)16-3-2-4-18(21)12-16/h2-6,11-13H,7-10,14H2,1H3,(H,23,25)/b22-13+
    MOLECULAR FORMULA
    C20H22BrN3O3
    CROSS REFERENCES
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    canSAR1646937
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight431.08
    AlogP3.05
    HBond donors1
    HBond acceptors6
    Atoms49
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1646937.