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canSAR1013978
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NAMES
    SMILES
    O=C(O)CC(=O)N1CCc2cc(-c3noc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)ccc21
    InChI
    InChI=1S/C21H13F6N3O4/c22-20(23,24)13-6-12(7-14(8-13)21(25,26)27)19-28-18(29-34-19)11-1-2-15-10(5-11)3-4-30(15)16(31)9-17(32)33/h1-2,5-8H,3-4,9H2,(H,32,33)
    MOLECULAR FORMULA
    C21H13F6N3O4
    CROSS REFERENCES
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    canSAR1013978

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.08
    AlogP 4.80
    HBond donors 1
    HBond acceptors 7
    Atoms 47
    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 canSAR1013978.