canSAR1388113
FEATURES
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NAMES
    SMILES
    Cc1ccc(CN2C[C@H]3CCCO[C@@H]3[C@H](NS(C)(=O)=O)C2)o1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C15H24N2O4S.C2HF3O2/c1-11-5-6-13(21-11)9-17-8-12-4-3-7-20-15(12)14(10-17)16-22(2,18)19;3-2(4,5)1(6)7/h5-6,12,14-16H,3-4,7-10H2,1-2H3;(H,6,7)
    MOLECULAR FORMULA
    C17H25F3N2O6S
    CROSS REFERENCES
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    canSAR1388113
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight442.14
    AlogP1.75
    HBond donors2
    HBond acceptors8
    Atoms54
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1388113.