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canSAR671268
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NAMES
    SMILES
    CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1ccc(N(C)C)cc1
    InChI
    InChI=1S/C21H19N5/c1-12-16(9-14-5-7-15(8-6-14)26(3)4)19-13(2)18(11-23)21(24)25-20(19)17(12)10-22/h5-9H,1-4H3,(H2,24,25)/b16-9+
    MOLECULAR FORMULA
    C21H19N5
    CROSS REFERENCES
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    canSAR671268

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 341.16
    AlogP 3.76
    HBond donors 2
    HBond acceptors 5
    Atoms 45
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR671268.