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canSAR2020247
FEATURES
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NAMES
    SMILES
    CCS(=O)(=O)N1C[C@@]2(C)O[C@@](C)(C1)c1c2c(O)n(-c2ccc(C#N)c(C(F)(F)F)c2)c1O
    InChI
    InChI=1S/C20H20F3N3O5S/c1-4-32(29,30)25-9-18(2)14-15(19(3,10-25)31-18)17(28)26(16(14)27)12-6-5-11(8-24)13(7-12)20(21,22)23/h5-7,27-28H,4,9-10H2,1-3H3/t18-,19+
    MOLECULAR FORMULA
    C20H20F3N3O5S
    CROSS REFERENCES
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    canSAR2020247

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.11
    AlogP 2.90
    HBond donors 2
    HBond acceptors 8
    Atoms 52
    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 canSAR2020247.