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canSAR1828565
FEATURES
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NAMES
    SMILES
    CC(C)(C)Nc1cc(-n2ncc3cc(C#N)cnc32)ncc1C(=O)NC[C@@H](F)C(C)(C)O
    InChI
    InChI=1S/C22H26FN7O2/c1-21(2,3)29-16-7-18(30-19-14(10-28-30)6-13(8-24)9-26-19)25-11-15(16)20(31)27-12-17(23)22(4,5)32/h6-7,9-11,17,32H,12H2,1-5H3,(H,25,29)(H,27,31)/t17-/m1/s1
    MOLECULAR FORMULA
    C22H26FN7O2
    CROSS REFERENCES
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    canSAR1828565

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.21
    AlogP 2.74
    HBond donors 3
    HBond acceptors 9
    Atoms 58
    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 canSAR1828565.