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canSAR1528494
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NAMES
    SMILES
    Cc1cc(C(N)=O)ccc1Nc1nccc(-c2ccc(N3CCCC3)c(C#N)c2)n1
    InChI
    InChI=1S/C23H22N6O/c1-15-12-17(22(25)30)4-6-19(15)27-23-26-9-8-20(28-23)16-5-7-21(18(13-16)14-24)29-10-2-3-11-29/h4-9,12-13H,2-3,10-11H2,1H3,(H2,25,30)(H,26,27,28)
    MOLECULAR FORMULA
    C23H22N6O
    CROSS REFERENCES
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    canSAR1528494

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.19
    AlogP 3.77
    HBond donors 3
    HBond acceptors 7
    Atoms 52
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1528494.