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  1. ALA4115574

    Name:
    US9145354, 166

    Mol. Formula:
    C18H20ClFN2O2

    M.W.:
    350.82

    Type:
    Small molecule

    AlogP:
    3.53

    Polar Surface Area:
    62.22

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  2. ALA4115441

    Name:
    US9145354, 19

    Mol. Formula:
    C16H14ClFN2O3

    M.W.:
    336.75

    Type:
    Small molecule

    AlogP:
    3.21

    Polar Surface Area:
    93.28

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  3. ALA4115380

    Name:
    US9206232, 79

    Mol. Formula:
    C44H73N7O7S

    M.W.:
    844.18

    Type:
    Small molecule

    AlogP:
    4.02

    Polar Surface Area:
    177.33

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  4. ALA4115317

    Name:
    US9145354, 189

    Mol. Formula:
    C21H24ClFN2O3

    M.W.:
    406.89

    Type:
    Small molecule

    AlogP:
    3.51

    Polar Surface Area:
    92.42

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  5. ALA4115269

    Name:
    US9145354, 195

    Mol. Formula:
    C19H21ClFN5O2

    M.W.:
    405.86

    Type:
    Small molecule

    AlogP:
    2.39

    Polar Surface Area:
    123.99

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  6. ALA4115234

    Name:
    US9145354, 20

    Mol. Formula:
    C13H12ClFN2OS

    M.W.:
    298.77

    Type:
    Small molecule

    AlogP:
    3.58

    Polar Surface Area:
    55.98

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  7. ALA4115214

    Name:
    US9145354, 298

    Mol. Formula:
    C21H25ClFN3O2

    M.W.:
    405.90

    Type:
    Small molecule

    AlogP:
    4.05

    Polar Surface Area:
    85.08

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  8. ALA4115089

    Name:
    US9145354, 107

    Mol. Formula:
    C19H21ClFN3O2

    M.W.:
    377.85

    Type:
    Small molecule

    AlogP:
    3.41

    Polar Surface Area:
    85.08

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  9. ALA4115044

    Name:
    US9145354, 254

    Mol. Formula:
    C20H22ClFN4O2

    M.W.:
    404.87

    Type:
    Small molecule

    AlogP:
    2.99

    Polar Surface Area:
    111.10

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  10. ALA4115041

    Name:
    US9206232, 66

    Mol. Formula:
    C46H73N7O7S

    M.W.:
    868.20

    Type:
    Small molecule

    AlogP:
    4.30

    Polar Surface Area:
    177.33

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  11. ALA4115040

    Name:
    US9145354, 65

    Mol. Formula:
    C18H18ClFN2O2

    M.W.:
    348.81

    Type:
    Small molecule

    AlogP:
    3.92

    Polar Surface Area:
    64.35

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  12. ALA4115038

    Name:
    US9145354, 50

    Mol. Formula:
    C17H17ClFNO2

    M.W.:
    321.78

    Type:
    Small molecule

    AlogP:
    3.61

    Polar Surface Area:
    63.32

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  13. ALA4114942

    Name:
    US9145354, 100

    Mol. Formula:
    C18H20ClFN4O2

    M.W.:
    378.83

    Type:
    Small molecule

    AlogP:
    2.80

    Polar Surface Area:
    97.97

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  14. ALA4114835

    Name:
    US9145354, 187

    Mol. Formula:
    C21H24ClFN2O3

    M.W.:
    406.89

    Type:
    Small molecule

    AlogP:
    3.51

    Polar Surface Area:
    92.42

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  15. ALA4114833

    Name:
    US9145354, 168

    Mol. Formula:
    C20H21ClFN3O2

    M.W.:
    389.86

    Type:
    Small molecule

    AlogP:
    3.41

    Polar Surface Area:
    85.08

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  16. ALA4114640

    Name:
    US9145354, 140

    Mol. Formula:
    C22H23ClFN5O2

    M.W.:
    443.91

    Type:
    Small molecule

    AlogP:
    3.60

    Polar Surface Area:
    102.90

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  17. ALA4114631

    Name:
    US9145354, 221

    Mol. Formula:
    C21H25ClFN3O2

    M.W.:
    405.90

    Type:
    Small molecule

    AlogP:
    3.91

    Polar Surface Area:
    98.21

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  18. ALA4114428

    Name:
    US9145354, 66

    Mol. Formula:
    C16H17ClFN3O

    M.W.:
    321.78

    Type:
    Small molecule

    AlogP:
    3.49

    Polar Surface Area:
    82.00

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  19. ALA4114412

    Name:
    US9145354, 8

    Mol. Formula:
    C16H14ClF2NO

    M.W.:
    309.74

    Type:
    Small molecule

    AlogP:
    4.26

    Polar Surface Area:
    43.09

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.86

    DETAILS
  20. ALA4114386

    Name:
    US9145354, 11

    Mol. Formula:
    C17H15ClFNO

    M.W.:
    303.76

    Type:
    Small molecule

    AlogP:
    4.12

    Polar Surface Area:
    43.09

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.86

    DETAILS
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