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canSAR1066750
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NAMES
    SMILES
    Cc1nn(C)c([N-]C(=O)Nc2ccc(Cl)c(Cl)c2)c1[N+]#N
    InChI
    InChI=1S/C12H10Cl2N6O/c1-6-10(18-15)11(20(2)19-6)17-12(21)16-7-3-4-8(13)9(14)5-7/h3-5H,1-2H3,(H-,16,17,19,21)
    MOLECULAR FORMULA
    C12H10Cl2N6O
    CROSS REFERENCES
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    canSAR1066750

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 324.03
    AlogP 4.76
    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 canSAR1066750.