canSAR741928
FEATURES
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NAMES
    SMILES
    CC1=C(S(=O)(=O)[O-])C(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)c(S(=O)(=O)[O-])c(C)n1[B-]2(F)F.[Na+].[Na+]
    InChI
    InChI=1S/C19H18BF2IN2O6S2.2Na/c1-9-16-15(13-5-7-14(23)8-6-13)17-10(2)19(33(29,30)31)12(4)25(17)20(21,22)24(16)11(3)18(9)32(26,27)28;;/h5-8H,1-4H3,(H,26,27,28)(H,29,30,31);;/q;2*+1/p-2
    MOLECULAR FORMULA
    C19H16BF2IN2Na2O6S2
    CROSS REFERENCES
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    canSAR741928
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight653.94
    AlogP-3.08
    HBond donors0
    HBond acceptors8
    Atoms51
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR741928.