canSAR739811
FEATURES
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NAMES
    SMILES
    CC1=C(/C=C/C(=O)/C=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(C)(C)CCC1
    InChI
    InChI=1S/C22H22F6O/c1-14-5-4-10-20(2,3)19(14)9-8-18(29)7-6-15-11-16(21(23,24)25)13-17(12-15)22(26,27)28/h6-9,11-13H,4-5,10H2,1-3H3/b7-6+,9-8+
    MOLECULAR FORMULA
    C22H22F6O
    CROSS REFERENCES
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    canSAR739811
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight416.16
    AlogP7.39
    HBond donors0
    HBond acceptors1
    Atoms51
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR739811.