canSAR869822
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ncc(-c3ccc(C(F)(F)F)cc3)cn1)C2
    InChI
    InChI=1S/C18H14F3N5O4/c19-18(20,21)13-3-1-11(2-4-13)12-5-22-15(23-6-12)10-29-14-7-25-8-16(26(27)28)24-17(25)30-9-14/h1-6,8,14H,7,9-10H2/t14-/m0/s1
    MOLECULAR FORMULA
    C18H14F3N5O4
    CROSS REFERENCES
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    canSAR869822
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight421.10
    AlogP3.24
    HBond donors0
    HBond acceptors9
    Atoms44
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR869822.