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canSAR935099
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NAMES
    SMILES
    O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cc(-c3ccc(C(F)(F)F)cc3)ccn1)C2
    InChI
    InChI=1S/C19H15F3N4O4/c20-19(21,22)14-3-1-12(2-4-14)13-5-6-23-15(7-13)10-29-16-8-25-9-17(26(27)28)24-18(25)30-11-16/h1-7,9,16H,8,10-11H2/t16-/m0/s1
    MOLECULAR FORMULA
    C19H15F3N4O4
    CROSS REFERENCES
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    canSAR935099

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.10
    AlogP 3.85
    HBond donors 0
    HBond acceptors 8
    Atoms 45
    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 canSAR935099.