canSAR1746736
FEATURES
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NAMES
    SMILES
    Cc1nn(Cc2cccc(C(N)=O)c2)c(C)c1Br
    InChI
    InChI=1S/C13H14BrN3O/c1-8-12(14)9(2)17(16-8)7-10-4-3-5-11(6-10)13(15)18/h3-6H,7H2,1-2H3,(H2,15,18)
    MOLECULAR FORMULA
    C13H14BrN3O
    CROSS REFERENCES
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    canSAR1746736
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight307.03
    AlogP2.41
    HBond donors2
    HBond acceptors4
    Atoms32
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746736.