canSAR1632106
FEATURES
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NAMES
    SMILES
    O=C(c1cccc(Br)c1)N1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1
    InChI
    InChI=1S/C21H18BrClN4O2/c22-16-6-4-5-15(13-16)20(28)26-11-9-25(10-12-26)18-14-24-27(21(29)19(18)23)17-7-2-1-3-8-17/h1-8,13-14H,9-12H2
    MOLECULAR FORMULA
    C21H18BrClN4O2
    CROSS REFERENCES
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    canSAR1632106
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight472.03
    AlogP3.61
    HBond donors0
    HBond acceptors6
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1632106.