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canSAR1720576
FEATURES
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NAMES
    SMILES
    C=C1C(=O)O[C@H]2[C@H]1CC/C(C(F)(F)F)=C\CC[C@@]1(C)O[C@@H]21
    InChI
    InChI=1S/C15H17F3O3/c1-8-10-6-5-9(15(16,17)18)4-3-7-14(2)12(21-14)11(10)20-13(8)19/h4,10-12H,1,3,5-7H2,2H3/b9-4+/t10-,11-,12-,14+/m0/s1
    MOLECULAR FORMULA
    C15H17F3O3
    CROSS REFERENCES
    1720576 logo

    canSAR1720576

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 302.11
    AlogP 3.30
    HBond donors 0
    HBond acceptors 3
    Atoms 38
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1720576.