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canSAR1059204
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NAMES
    SMILES
    Cc1cc(F)ccc1OC1CCN(CC2CCN([C@@H](Cc3ccc(F)cc3)C(=O)O)CC2)CC1
    InChI
    InChI=1S/C27H34F2N2O3/c1-19-16-23(29)6-7-26(19)34-24-10-12-30(13-11-24)18-21-8-14-31(15-9-21)25(27(32)33)17-20-2-4-22(28)5-3-20/h2-7,16,21,24-25H,8-15,17-18H2,1H3,(H,32,33)/t25-/m0/s1
    MOLECULAR FORMULA
    C27H34F2N2O3
    CROSS REFERENCES
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    canSAR1059204

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 472.25
    AlogP 4.52
    HBond donors 1
    HBond acceptors 5
    Atoms 68
    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 canSAR1059204.