canSAR416802
FEATURES
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NAMES
    SMILES
    C=C(CN1CCOCC1)C(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1
    InChI
    InChI=1S/C22H22BrN5O2/c1-15(13-28-7-9-30-10-8-28)22(29)27-18-5-6-20-19(12-18)21(25-14-24-20)26-17-4-2-3-16(23)11-17/h2-6,11-12,14H,1,7-10,13H2,(H,27,29)(H,24,25,26)
    MOLECULAR FORMULA
    C22H22BrN5O2
    CROSS REFERENCES
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    canSAR416802
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight467.10
    AlogP3.96
    HBond donors2
    HBond acceptors7
    Atoms52
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR416802.