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canSAR1064038
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NAMES
    SMILES
    Cc1nn(C)c([N-]C(=O)Nc2ccc(Cl)cc2)c1[N+]#N
    InChI
    InChI=1S/C12H11ClN6O/c1-7-10(17-14)11(19(2)18-7)16-12(20)15-9-5-3-8(13)4-6-9/h3-6H,1-2H3,(H-,15,16,18,20)
    MOLECULAR FORMULA
    C12H11ClN6O
    CROSS REFERENCES
    1064038 logo

    canSAR1064038

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 290.07
    AlogP 4.10
    HBond donors 1
    HBond acceptors 7
    Atoms 31
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1064038.