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  1. ALA5094949

    Name:
    (S)-3-amino-1-(4-fluoro-3-(2-propylpentyloxy)phenyl)propan-1-ol

    Mol. Formula:
    C17H28FNO2

    M.W.:
    297.41

    Type:
    Unknown

    AlogP:
    3.80

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  2. ALA5094849

    Name:
    3-amino-1-(2-fluoro-5-((2,6,6-trimethylcyclohex-1-enyl)methoxy)phenyl)propaShow More

    Mol. Formula:
    C19H28FNO2

    M.W.:
    321.44

    Type:
    Unknown

    AlogP:
    4.11

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  3. ALA5092414

    Name:
    3-amino-1-(4-fluoro-3-((2,6,6-trimethylcyclohex-1-enyl)methoxy)phenyl)propaShow More

    Mol. Formula:
    C19H28FNO2

    M.W.:
    321.44

    Type:
    Unknown

    AlogP:
    4.11

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  4. ALA5091011

    Name:
    3-amino-1-(3-(cyclohexylmethoxy)-4-fluorophenyl)propan-1-ol

    Mol. Formula:
    C16H24FNO2

    M.W.:
    281.37

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  5. ALA5086566

    Name:
    3-amino-1-(3-fluoro-5-((2,6,6-trimethylcyclohex-1-enyl)methoxy)phenyl)propaShow More

    Mol. Formula:
    C19H28FNO2

    M.W.:
    321.44

    Type:
    Unknown

    AlogP:
    4.11

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  6. ALA5084662

    Name:
    3-amino-1-(3-(cyclohexylmethoxy)-5-fluorophenyl)propan-1-ol

    Mol. Formula:
    C16H24FNO2

    M.W.:
    281.37

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  7. ALA5083918

    Name:
    (R)-3-amino-1-(4-fluoro-3-(2-propylpentyloxy)phenyl)propan-1-ol

    Mol. Formula:
    C17H28FNO2

    M.W.:
    297.41

    Type:
    Unknown

    AlogP:
    3.80

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  8. ALA5083435

    Name:
    (R/S)-3-amino-1-(2-fluoro-3-(2-propylpentyloxy)phenyl)propan-1-ol

    Mol. Formula:
    C17H28FNO2

    M.W.:
    297.41

    Type:
    Unknown

    AlogP:
    3.80

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  9. ALA5081640

    Name:
    3-amino-1-(2-fluoro-3-((2,6,6-trimethylcyclohex-1-enyl)methoxy)phenyl)propaShow More

    Mol. Formula:
    C19H28FNO2

    M.W.:
    321.44

    Type:
    Unknown

    AlogP:
    4.11

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  10. ALA5081450

    Name:
    3-amino-1-(5-(cyclohexylmethoxy)-2-fluorophenyl)propan-1-ol

    Mol. Formula:
    C16H24FNO2

    M.W.:
    281.37

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  11. ALA5080647

    Name:
    3-amino-1-(3-((4,4-difluorocyclohexyl)methoxy)phenyl)propan-1-ol

    Mol. Formula:
    C16H23F2NO2

    M.W.:
    299.36

    Type:
    Unknown

    AlogP:
    3.27

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  12. ALA5077356

    Name:
    (R/S)-3-Amino-1-(3-fluoro-5-((2-propylpentyl)oxy)phenyl)propan-1-ol

    Mol. Formula:
    C17H28FNO2

    M.W.:
    297.41

    Type:
    Unknown

    AlogP:
    3.80

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  13. ALA5076106

    Name:
    3-amino-1-(3-(cyclohexylmethoxy)-2-fluorophenyl)propan-1-ol

    Mol. Formula:
    C16H24FNO2

    M.W.:
    281.37

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  14. ALA5075304

    Name:
    3-Amino-1-(3-((4,4-difluorocyclohexyl)methoxylphenyl)propan-3,3-d2-1-ol

    Mol. Formula:
    C16H23F2NO2

    M.W.:
    301.37

    Type:
    Unknown

    AlogP:
    3.27

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  15. ALA5069771

    Name:
    (R/S)-3-amino-1-(2-fluoro-5-(2-propylpentyloxy)phenyl)propan-1-ol

    Mol. Formula:
    C17H28FNO2

    M.W.:
    297.41

    Type:
    Unknown

    AlogP:
    3.80

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  16. ALA4795212

    Name:
    ((R/S)-3-amino-1-(3-((5-fluoro-2-(3-fluoropropyl)pentyl)oxy)phenyl)propan-1Show More

    Mol. Formula:
    C17H27F2NO2

    M.W.:
    315.40

    Type:
    Unknown

    AlogP:
    3.56

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  17. ALA4781327

    Name:
    Rac-Emixustat

    Mol. Formula:
    C16H25NO2

    M.W.:
    263.38

    Type:
    Unknown

    AlogP:
    3.03

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  18. ALA4757869

    Name:
    (1R)-3-amino-1-[3-[(2,6,6-trimethylcyclohexen-1-yl)methoxy]phenyl]propan-1-Show More

    Mol. Formula:
    C19H29NO2

    M.W.:
    303.45

    Type:
    Unknown

    AlogP:
    3.97

    Polar Surface Area:
    55.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  19. ALA4563763

    Name:
    4-Trifluoromethylphenyl t-butyl nitrone

    Mol. Formula:
    C12H14F3NO

    M.W.:
    245.24

    Type:
    Unknown

    AlogP:
    3.43

    Polar Surface Area:
    26.07

    HBA:
    1

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  20. ALA4561265

    Name:
    4-Ethoxyphenyl t-butyl nitrone

    Mol. Formula:
    C13H19NO2

    M.W.:
    221.30

    Type:
    Unknown

    AlogP:
    2.81

    Polar Surface Area:
    35.30

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.34

    DETAILS
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