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  1. ALA4290291

    Name:
    4-Cyano-1H-imidazole-2-carboxylic acid {2-(4,4-dimethyl-cyclohex-1-enyl)-4-Show More

    Mol. Formula:
    C24H32ClN5O2

    M.W.:
    458.01

    Type:
    Small molecule

    AlogP:
    3.94

    Polar Surface Area:
    113.83

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  2. ALA4112693

    Name:
    US9394289, 94

    Mol. Formula:
    C29H33N5O2

    M.W.:
    483.62

    Type:
    Small molecule

    AlogP:
    6.01

    Polar Surface Area:
    114.59

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  3. ALA3987062

    Name:
    US9394289, 32

    Mol. Formula:
    C25H31N5O3

    M.W.:
    449.56

    Type:
    Small molecule

    AlogP:
    4.30

    Polar Surface Area:
    123.92

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  4. ALA3986577

    Name:
    US8497376, 13

    Mol. Formula:
    C28H34N4O4

    M.W.:
    490.60

    Type:
    Small molecule

    AlogP:
    4.27

    Polar Surface Area:
    131.26

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  5. ALA3986237

    Name:
    US9394289, 15

    Mol. Formula:
    C22H24N4O4S

    M.W.:
    440.53

    Type:
    Small molecule

    AlogP:
    2.89

    Polar Surface Area:
    135.94

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  6. ALA3985982

    Name:
    US9394289, 12

    Mol. Formula:
    C24H28N4O4S

    M.W.:
    468.58

    Type:
    Small molecule

    AlogP:
    3.52

    Polar Surface Area:
    135.94

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  7. ALA3982733

    Name:
    US9403804, 44

    Mol. Formula:
    C29H37N5O3

    M.W.:
    503.65

    Type:
    Small molecule

    AlogP:
    4.59

    Polar Surface Area:
    114.27

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  8. ALA3981992

    Name:
    US9394289, 21

    Mol. Formula:
    C27H33N5O3

    M.W.:
    475.59

    Type:
    Small molecule

    AlogP:
    3.87

    Polar Surface Area:
    103.27

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  9. ALA3981521

    Name:
    US9394289, 34

    Mol. Formula:
    C23H26N4O4S

    M.W.:
    454.55

    Type:
    Small molecule

    AlogP:
    3.54

    Polar Surface Area:
    124.94

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  10. ALA3980890

    Name:
    US9394289, 10

    Mol. Formula:
    C30H38N6O4

    M.W.:
    546.67

    Type:
    Small molecule

    AlogP:
    3.84

    Polar Surface Area:
    134.58

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  11. ALA3979814

    Name:
    US9394289, 8

    Mol. Formula:
    C29H38N6O2

    M.W.:
    502.66

    Type:
    Small molecule

    AlogP:
    4.38

    Polar Surface Area:
    97.28

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  12. ALA3974798

    Name:
    US9394289, 88

    Mol. Formula:
    C28H36N4O3

    M.W.:
    476.62

    Type:
    Small molecule

    AlogP:
    5.68

    Polar Surface Area:
    111.03

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  13. ALA3973846

    Name:
    US9394289, 27

    Mol. Formula:
    C22H24N4O3

    M.W.:
    392.46

    Type:
    Small molecule

    AlogP:
    3.49

    Polar Surface Area:
    111.03

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  14. ALA3971362

    Name:
    US9403804, 28

    Mol. Formula:
    C30H40N6O

    M.W.:
    500.69

    Type:
    Small molecule

    AlogP:
    5.40

    Polar Surface Area:
    88.05

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  15. ALA3970630

    Name:
    US9394289, 26

    Mol. Formula:
    C29H37N5O3

    M.W.:
    503.65

    Type:
    Small molecule

    AlogP:
    4.51

    Polar Surface Area:
    103.27

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  16. ALA3968152

    Name:
    US8497376, 19

    Mol. Formula:
    C25H29N5O4

    M.W.:
    463.54

    Type:
    Small molecule

    AlogP:
    3.03

    Polar Surface Area:
    144.15

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  17. ALA3966465

    Name:
    US9394289, 87

    Mol. Formula:
    C25H27N5O3S

    M.W.:
    477.59

    Type:
    Small molecule

    AlogP:
    4.10

    Polar Surface Area:
    139.50

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  18. ALA3966302

    Name:
    US9394289, 90

    Mol. Formula:
    C26H30F3N5O2

    M.W.:
    501.55

    Type:
    Small molecule

    AlogP:
    4.97

    Polar Surface Area:
    105.04

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  19. ALA3965172

    Name:
    US9394289, 5

    Mol. Formula:
    C24H29N5O2

    M.W.:
    419.53

    Type:
    Small molecule

    AlogP:
    4.09

    Polar Surface Area:
    116.82

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  20. ALA3963729

    Name:
    US8497376, 9

    Mol. Formula:
    C28H32N4O3

    M.W.:
    472.59

    Type:
    Small molecule

    AlogP:
    5.21

    Polar Surface Area:
    111.03

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
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