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canSAR1975099
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)N[C@@H](CC(=O)O)c2ccccc2F)nc1-c1ccc(C#N)cc1
    InChI
    InChI=1S/C23H18FN3O4/c1-31-20-11-10-18(26-22(20)15-8-6-14(13-25)7-9-15)23(30)27-19(12-21(28)29)16-4-2-3-5-17(16)24/h2-11,19H,12H2,1H3,(H,27,30)(H,28,29)/t19-/m0/s1
    MOLECULAR FORMULA
    C23H18FN3O4
    CROSS REFERENCES
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    canSAR1975099

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.13
    AlogP 3.71
    HBond donors 2
    HBond acceptors 7
    Atoms 49
    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 canSAR1975099.