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canSAR227704
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NAMES
    SMILES
    O=C(O)C[C@@H]1CC[C@H](c2ccc(-c3noc(-c4ccc(C5CCCC5)c(F)c4)n3)cc2)N1
    InChI
    InChI=1S/C25H26FN3O3/c26-21-13-18(9-11-20(21)15-3-1-2-4-15)25-28-24(29-32-25)17-7-5-16(6-8-17)22-12-10-19(27-22)14-23(30)31/h5-9,11,13,15,19,22,27H,1-4,10,12,14H2,(H,30,31)/t19-,22+/m0/s1
    MOLECULAR FORMULA
    C25H26FN3O3
    CROSS REFERENCES
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    canSAR227704

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.20
    AlogP 5.47
    HBond donors 2
    HBond acceptors 6
    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 canSAR227704.