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canSAR1405636
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NAMES
    SMILES
    C[C@H](c1ccc(F)cc1)N1C(=O)O[C@](Cc2ccccc2)(c2nc3cc(C#N)ccc3[nH]2)C1=O
    InChI
    InChI=1S/C26H19FN4O3/c1-16(19-8-10-20(27)11-9-19)31-24(32)26(34-25(31)33,14-17-5-3-2-4-6-17)23-29-21-12-7-18(15-28)13-22(21)30-23/h2-13,16H,14H2,1H3,(H,29,30)/t16-,26-/m1/s1
    MOLECULAR FORMULA
    C26H19FN4O3
    CROSS REFERENCES
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    canSAR1405636

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.14
    AlogP 4.75
    HBond donors 1
    HBond acceptors 7
    Atoms 53
    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 canSAR1405636.