canSAR2095853
FEATURES
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NAMES
    SMILES
    CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2ccccn2)CC1
    InChI
    InChI=1S/C33H34F6N4O4/c1-2-6-27-31(47-24-10-8-22(9-11-24)32(34,35)36,30(45)42-19-13-23(14-20-42)46-28-7-3-4-16-41-28)15-5-18-43(27)29(44)25-21-40-17-12-26(25)33(37,38)39/h3-4,7-12,16-17,21,23,27H,2,5-6,13-15,18-20H2,1H3/t27-,31+/m1/s1
    MOLECULAR FORMULA
    C33H34F6N4O4
    CROSS REFERENCES
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    canSAR2095853
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight664.25
    AlogP6.81
    HBond donors0
    HBond acceptors8
    Atoms81
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095853.