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canSAR39743
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NAMES
    SMILES
    C[C@@]1(C(F)(F)F)CN(c2cccc[n+]2[O-])c2cc(S(=O)(=O)c3ccccc3)ccc2O1
    InChI
    InChI=1S/C21H17F3N2O4S/c1-20(21(22,23)24)14-25(19-9-5-6-12-26(19)27)17-13-16(10-11-18(17)30-20)31(28,29)15-7-3-2-4-8-15/h2-13H,14H2,1H3/t20-/m0/s1
    MOLECULAR FORMULA
    C21H17F3N2O4S
    CROSS REFERENCES
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    canSAR39743

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.09
    AlogP 4.00
    HBond donors 0
    HBond acceptors 6
    Atoms 48
    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 canSAR39743.