canSAR2080142
FEATURES
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NAMES
    SMILES
    CCc1cc(-c2c[nH]c3ncc(Br)cc23)nc(N)n1
    InChI
    InChI=1S/C13H12BrN5/c1-2-8-4-11(19-13(15)18-8)10-6-17-12-9(10)3-7(14)5-16-12/h3-6H,2H2,1H3,(H,16,17)(H2,15,18,19)
    MOLECULAR FORMULA
    C13H12BrN5
    CROSS REFERENCES
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    canSAR2080142
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight317.03
    AlogP2.93
    HBond donors3
    HBond acceptors5
    Atoms31
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080142.