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  1. ALA3987025

    Name:
    US9173869, 74

    Mol. Formula:
    C25H20F4N4O2

    M.W.:
    484.45

    Type:
    Small molecule

    AlogP:
    5.30

    Polar Surface Area:
    76.02

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  2. ALA3984905

    Name:
    US9173869, 51

    Mol. Formula:
    C25H20FN5O2

    M.W.:
    441.47

    Type:
    Small molecule

    AlogP:
    4.62

    Polar Surface Area:
    91.02

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  3. ALA3982206

    Name:
    US9173869, 47

    Mol. Formula:
    C25H32N2O4

    M.W.:
    424.54

    Type:
    Small molecule

    AlogP:
    4.14

    Polar Surface Area:
    67.87

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  4. ALA3973379

    Name:
    US9173869, 61

    Mol. Formula:
    C25H19ClF4N4O2

    M.W.:
    518.90

    Type:
    Small molecule

    AlogP:
    6.42

    Polar Surface Area:
    67.23

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  5. ALA3976300

    Name:
    US9173869, 49

    Mol. Formula:
    C25H31ClN2O3

    M.W.:
    442.99

    Type:
    Small molecule

    AlogP:
    4.93

    Polar Surface Area:
    58.64

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  6. ALA3965866

    Name:
    US9173869, 68

    Mol. Formula:
    C22H15Cl2FN4O2

    M.W.:
    457.29

    Type:
    Small molecule

    AlogP:
    5.15

    Polar Surface Area:
    76.02

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  7. ALA3955093

    Name:
    US9173869, 32

    Mol. Formula:
    C26H22F4N4O2

    M.W.:
    498.48

    Type:
    Small molecule

    AlogP:
    6.16

    Polar Surface Area:
    67.23

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  8. ALA3953566

    Name:
    US9173869, 66

    Mol. Formula:
    C24H19ClFN5O4

    M.W.:
    495.90

    Type:
    Small molecule

    AlogP:
    5.31

    Polar Surface Area:
    110.37

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  9. ALA3947836

    Name:
    US9173869, 59

    Mol. Formula:
    C25H22FN5O4

    M.W.:
    475.48

    Type:
    Small molecule

    AlogP:
    4.97

    Polar Surface Area:
    110.37

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  10. ALA3946409

    Name:
    US9173869, 36

    Mol. Formula:
    C27H24F4N4O2

    M.W.:
    512.51

    Type:
    Small molecule

    AlogP:
    6.55

    Polar Surface Area:
    67.23

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  11. ALA3944845

    Name:
    US9173869, 53

    Mol. Formula:
    C24H19Cl2FN4O2

    M.W.:
    485.35

    Type:
    Small molecule

    AlogP:
    6.06

    Polar Surface Area:
    67.23

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  12. ALA3944844

    Name:
    US9173869, 64

    Mol. Formula:
    C24H19ClFN5O4

    M.W.:
    495.90

    Type:
    Small molecule

    AlogP:
    5.31

    Polar Surface Area:
    110.37

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  13. ALA3944577

    Name:
    US9173869, 43

    Mol. Formula:
    C27H24Cl2FN5O2

    M.W.:
    540.43

    Type:
    Small molecule

    AlogP:
    5.74

    Polar Surface Area:
    70.47

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  14. ALA3943779

    Name:
    US9173869, 58

    Mol. Formula:
    C23H18Cl2FN5O2

    M.W.:
    486.33

    Type:
    Small molecule

    AlogP:
    5.45

    Polar Surface Area:
    80.12

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  15. ALA3939466

    Name:
    US9173869, 62

    Mol. Formula:
    C24H19ClFN5O4

    M.W.:
    495.90

    Type:
    Small molecule

    AlogP:
    5.31

    Polar Surface Area:
    110.37

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  16. ALA3935979

    Name:
    US9173869, 69

    Mol. Formula:
    C22H15ClFN5O4

    M.W.:
    467.84

    Type:
    Small molecule

    AlogP:
    4.41

    Polar Surface Area:
    119.16

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  17. ALA3935587

    Name:
    US9173869, 40

    Mol. Formula:
    C36H37N3O2

    M.W.:
    543.71

    Type:
    Small molecule

    AlogP:
    7.83

    Polar Surface Area:
    55.20

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  18. ALA3935394

    Name:
    US9173869, 52

    Mol. Formula:
    C25H20F4N4O2S

    M.W.:
    516.52

    Type:
    Small molecule

    AlogP:
    6.36

    Polar Surface Area:
    67.23

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  19. ALA3934812

    Name:
    US9173869, 56

    Mol. Formula:
    C30H25FN4O2

    M.W.:
    492.55

    Type:
    Small molecule

    AlogP:
    6.42

    Polar Surface Area:
    67.23

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  20. ALA3933970

    Name:
    US9173869, 39

    Mol. Formula:
    C31H34FN3O2

    M.W.:
    499.63

    Type:
    Small molecule

    AlogP:
    6.36

    Polar Surface Area:
    55.20

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
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