canSAR2096467
FEATURES
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NAMES
    SMILES
    COCCO[C@H]1CCN(Cc2cccs2)[C@H]1Cc1cccnc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C18H24N2O2S.2C2HF3O2/c1-21-9-10-22-18-6-8-20(14-16-5-3-11-23-16)17(18)12-15-4-2-7-19-13-15;2*3-2(4,5)1(6)7/h2-5,7,11,13,17-18H,6,8-10,12,14H2,1H3;2*(H,6,7)/t17-,18-;;/m0../s1
    MOLECULAR FORMULA
    C22H26F6N2O6S
    CROSS REFERENCES
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    canSAR2096467
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight560.14
    AlogP4.26
    HBond donors2
    HBond acceptors8
    Atoms63
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096467.