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  1. ALA4094939

    Name:
    2-(2-methyl-1-(4-(methylsulfonyl)benzyl)-1H-indol-
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    Mol. Formula:
    C19H19NO4S

    M.W.:
    357.43

    Type:
    Small molecule

    AlogP:
    3.03

    Polar Surface Area:
    76.37

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  2. ALA4102679

    Name:
    2-(5-bromo-2-methyl-1-(4-(methylsulfonyl)benzyl)-1
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    Mol. Formula:
    C18H17BrN2O4S

    M.W.:
    437.32

    Type:
    Small molecule

    AlogP:
    3.19

    Polar Surface Area:
    89.26

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  3. ALA4086277

    Name:
    2-(6-ethyl-2-methyl-1-(4-(methylsulfonyl)benzyl)-1
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    Mol. Formula:
    C20H22N2O4S

    M.W.:
    386.47

    Type:
    Small molecule

    AlogP:
    2.99

    Polar Surface Area:
    89.26

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  4. ALA3987165

    Name:
    US9255090, 402

    Mol. Formula:
    C27H24ClF2NO5

    M.W.:
    515.94

    Type:
    Small molecule

    AlogP:
    6.01

    Polar Surface Area:
    76.07

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  5. ALA3986926

    Name:
    US9255090, 137

    Mol. Formula:
    C22H25FN2O4

    M.W.:
    400.45

    Type:
    Small molecule

    AlogP:
    3.61

    Polar Surface Area:
    78.87

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  6. ALA3986761

    Name:
    US9169270, 82

    Mol. Formula:
    C22H17ClF2N2O5S

    M.W.:
    494.90

    Type:
    Small molecule

    AlogP:
    4.82

    Polar Surface Area:
    88.96

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  7. ALA3986652

    Name:
    US9255090, 307

    Mol. Formula:
    C29H25F4NO5

    M.W.:
    543.51

    Type:
    Small molecule

    AlogP:
    5.51

    Polar Surface Area:
    76.07

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  8. ALA3986637

    Name:
    US9255090, 269

    Mol. Formula:
    C29H28FNO4

    M.W.:
    473.54

    Type:
    Small molecule

    AlogP:
    5.13

    Polar Surface Area:
    66.84

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  9. ALA3986592

    Name:
    US9255090, 414

    Mol. Formula:
    C27H26FNO6

    M.W.:
    479.50

    Type:
    Small molecule

    AlogP:
    5.05

    Polar Surface Area:
    85.30

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  10. ALA3986474

    Name:
    US9255090, 67

    Mol. Formula:
    C28H26FN3O4

    M.W.:
    487.53

    Type:
    Small molecule

    AlogP:
    4.45

    Polar Surface Area:
    84.66

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  11. ALA3986141

    Name:
    US9255090, 363

    Mol. Formula:
    C29H29F2NO4

    M.W.:
    493.55

    Type:
    Small molecule

    AlogP:
    5.52

    Polar Surface Area:
    66.84

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  12. ALA3986049

    Name:
    US9206164, 50

    Mol. Formula:
    C23H22F2N4O2

    M.W.:
    424.45

    Type:
    Small molecule

    AlogP:
    4.50

    Polar Surface Area:
    83.80

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  13. ALA3985850

    Name:
    US9255090, 234

    Mol. Formula:
    C29H30FNO4

    M.W.:
    475.56

    Type:
    Small molecule

    AlogP:
    5.60

    Polar Surface Area:
    66.84

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  14. ALA3985541

    Name:
    US9255090, 219

    Mol. Formula:
    C30H30FNO4

    M.W.:
    487.57

    Type:
    Small molecule

    AlogP:
    5.52

    Polar Surface Area:
    66.84

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  15. ALA3985486

    Name:
    US9255090, 266

    Mol. Formula:
    C27H27FN2O4

    M.W.:
    462.52

    Type:
    Small molecule

    AlogP:
    4.60

    Polar Surface Area:
    79.73

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  16. ALA3985401

    Name:
    US9169270, 4

    Mol. Formula:
    C22H20ClN3O4S

    M.W.:
    457.94

    Type:
    Small molecule

    AlogP:
    4.12

    Polar Surface Area:
    91.76

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  17. ALA3985005

    Name:
    US9255090, 174

    Mol. Formula:
    C27H26FNO5

    M.W.:
    463.51

    Type:
    Small molecule

    AlogP:
    5.43

    Polar Surface Area:
    76.07

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  18. ALA3984755

    Name:
    US9169270, 91

    Mol. Formula:
    C23H25ClN4O5S

    M.W.:
    505.00

    Type:
    Small molecule

    AlogP:
    4.11

    Polar Surface Area:
    106.78

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  19. ALA3984614

    Name:
    US9169270, 95

    Mol. Formula:
    C20H17ClN4O5S

    M.W.:
    460.90

    Type:
    Small molecule

    AlogP:
    3.33

    Polar Surface Area:
    114.74

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  20. ALA3984341

    Name:
    US9255090, 110

    Mol. Formula:
    C28H26FNO4

    M.W.:
    459.52

    Type:
    Small molecule

    AlogP:
    4.43

    Polar Surface Area:
    66.84

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
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