canSAR164910
FEATURES
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NAMES
    SMILES
    CC(C(=O)O)N(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
    InChI
    InChI=1S/C18H11F17N2O6S/c1-7(10(38)39)36(6-8-4-2-3-5-9(8)37(40)41)44(42,43)18(34,35)16(29,30)14(25,26)12(21,22)11(19,20)13(23,24)15(27,28)17(31,32)33/h2-5,7H,6H2,1H3,(H,38,39)
    MOLECULAR FORMULA
    C18H11F17N2O6S
    CROSS REFERENCES
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    canSAR164910
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight706.01
    AlogP6.17
    HBond donors1
    HBond acceptors8
    Atoms55
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR164910.