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canSAR2204522
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NAMES
    SMILES
    Cn1cc(-c2cc3c(N4CC(C(=O)Nc5ccc(C#N)cc5)C4)ncnn3c2)cn1
    InChI
    InChI=1S/C21H18N8O/c1-27-9-16(8-24-27)15-6-19-20(23-13-25-29(19)12-15)28-10-17(11-28)21(30)26-18-4-2-14(7-22)3-5-18/h2-6,8-9,12-13,17H,10-11H2,1H3,(H,26,30)
    MOLECULAR FORMULA
    C21H18N8O
    CROSS REFERENCES
    2204522 logo

    canSAR2204522

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.16
    AlogP 2.08
    HBond donors 1
    HBond acceptors 9
    Atoms 48
    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 canSAR2204522.