canSAR2215064
FEATURES
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NAMES
    SMILES
    COc1ccc(-c2ccc(C3=NO[C@@H](C[C@](C)(C(=O)NO)S(C)(=O)=O)C3)cc2F)c(C)c1
    InChI
    InChI=1S/C22H25FN2O6S/c1-13-9-15(30-3)6-8-17(13)18-7-5-14(10-19(18)23)20-11-16(31-25-20)12-22(2,21(26)24-27)32(4,28)29/h5-10,16,27H,11-12H2,1-4H3,(H,24,26)/t16-,22-/m1/s1
    MOLECULAR FORMULA
    C22H25FN2O6S
    CROSS REFERENCES
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    canSAR2215064
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight464.14
    AlogP3.00
    HBond donors2
    HBond acceptors8
    Atoms57
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2215064.