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canSAR1101269
FEATURES
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NAMES
    SMILES
    CCC(CC)(c1ccc(/C=C/C(O)(C(F)(F)F)C(F)(F)F)c(C)c1)c1ccc(-c2ccc(CC(=O)O)cc2)c(C)c1
    InChI
    InChI=1S/C32H32F6O3/c1-5-29(6-2,26-13-14-27(21(4)18-26)24-9-7-22(8-10-24)19-28(39)40)25-12-11-23(20(3)17-25)15-16-30(41,31(33,34)35)32(36,37)38/h7-18,41H,5-6,19H2,1-4H3,(H,39,40)/b16-15+
    MOLECULAR FORMULA
    C32H32F6O3
    CROSS REFERENCES
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    canSAR1101269

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 578.23
    AlogP 8.57
    HBond donors 2
    HBond acceptors 3
    Atoms 73
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1101269.