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canSAR1146754
FEATURES
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NAMES
    SMILES
    COC[C@@H](Oc1cc(C[C@@H]2C[S@@+]([O-])C[C@H](NCCCOC(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F
    InChI
    InChI=1S/C23H36F4N2O5S/c1-22(2,3)33-7-5-6-29-17-13-35(31)12-15(21(17)30)8-14-9-16(24)20(28)18(10-14)34-19(11-32-4)23(25,26)27/h9-10,15,17,19,21,29-30H,5-8,11-13,28H2,1-4H3/t15-,17+,19-,21+,35-/m1/s1
    MOLECULAR FORMULA
    C23H36F4N2O5S
    CROSS REFERENCES
    1146754 logo

    canSAR1146754

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 528.23
    AlogP 2.81
    HBond donors 4
    HBond acceptors 7
    Atoms 71
    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 canSAR1146754.