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canSAR1059419
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NAMES
    SMILES
    COc1ccc(OC(F)(F)F)cc1[C@H]1COC2(CCCN[C@H]2c2ccccc2)C1
    InChI
    InChI=1S/C22H24F3NO3/c1-27-19-9-8-17(29-22(23,24)25)12-18(19)16-13-21(28-14-16)10-5-11-26-20(21)15-6-3-2-4-7-15/h2-4,6-9,12,16,20,26H,5,10-11,13-14H2,1H3/t16-,20+,21?/m1/s1
    MOLECULAR FORMULA
    C22H24F3NO3
    CROSS REFERENCES
    1059419 logo

    canSAR1059419

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 407.17
    AlogP 4.96
    HBond donors 1
    HBond acceptors 4
    Atoms 53
    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 canSAR1059419.