canSAR1774993
FEATURES
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NAMES
    SMILES
    CS(C)(=O)=Nc1cccc(-c2ccc(C[C@@H](C#N)NC(=O)[C@H]3N[C@@H]4CC[C@H]3C4)c(F)c2)c1
    InChI
    InChI=1S/C24H27FN4O2S/c1-32(2,31)29-20-5-3-4-15(10-20)16-6-7-17(22(25)13-16)11-21(14-26)28-24(30)23-18-8-9-19(12-18)27-23/h3-7,10,13,18-19,21,23,27H,8-9,11-12H2,1-2H3,(H,28,30)/t18-,19+,21-,23-/m0/s1
    MOLECULAR FORMULA
    C24H27FN4O2S
    CROSS REFERENCES
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    canSAR1774993
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight454.18
    AlogP3.54
    HBond donors2
    HBond acceptors6
    Atoms59
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1774993.