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canSAR1146526
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NAMES
    SMILES
    CCC(=O)Nc1cc(CNc2c(C#N)c(C)nn2-c2ccc3ncccc3c2)cc(Cl)c1O
    InChI
    InChI=1S/C24H21ClN6O2/c1-3-22(32)29-21-10-15(9-19(25)23(21)33)13-28-24-18(12-26)14(2)30-31(24)17-6-7-20-16(11-17)5-4-8-27-20/h4-11,28,33H,3,13H2,1-2H3,(H,29,32)
    MOLECULAR FORMULA
    C24H21ClN6O2
    CROSS REFERENCES
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    canSAR1146526

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 460.14
    AlogP 4.92
    HBond donors 3
    HBond acceptors 8
    Atoms 54
    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 canSAR1146526.