canSAR2095771
FEATURES
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NAMES
    SMILES
    O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.c1cncc(OC[C@]23COC[C@H]2CN(C2CCC2)C3)c1
    InChI
    InChI=1S/C16H22N2O2.2C2HF3O2/c1-3-14(4-1)18-8-13-9-19-11-16(13,10-18)12-20-15-5-2-6-17-7-15;2*3-2(4,5)1(6)7/h2,5-7,13-14H,1,3-4,8-12H2;2*(H,6,7)/t13-,16+;;/m1../s1
    MOLECULAR FORMULA
    C20H24F6N2O6
    CROSS REFERENCES
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    canSAR2095771
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight502.15
    AlogP3.23
    HBond donors2
    HBond acceptors8
    Atoms58
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095771.