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  1. ALA3662053

    Name:
    US8912224, 315

    Mol. Formula:
    C22H20N2O3S

    M.W.:
    392.48

    Type:
    Small molecule

    AlogP:
    4.89

    Polar Surface Area:
    60.45

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  2. ALA3662052

    Name:
    US8912224, 151

    Mol. Formula:
    C24H23N3O2S2

    M.W.:
    449.60

    Type:
    Small molecule

    AlogP:
    6.42

    Polar Surface Area:
    56.27

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  3. ALA3662051

    Name:
    US8912224, 97

    Mol. Formula:
    C29H31N3O5S

    M.W.:
    533.65

    Type:
    Small molecule

    AlogP:
    6.37

    Polar Surface Area:
    95.71

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  4. ALA3662050

    Name:
    US8912224, 188

    Mol. Formula:
    C25H24N2O5S

    M.W.:
    464.54

    Type:
    Small molecule

    AlogP:
    4.83

    Polar Surface Area:
    86.75

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  5. ALA3662049

    Name:
    US8912224, 179

    Mol. Formula:
    C27H25N3O3S

    M.W.:
    471.58

    Type:
    Small molecule

    AlogP:
    5.94

    Polar Surface Area:
    73.34

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  6. ALA3662048

    Name:
    US8912224, 121

    Mol. Formula:
    C25H26N2O2S

    M.W.:
    418.56

    Type:
    Small molecule

    AlogP:
    6.13

    Polar Surface Area:
    34.59

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  7. ALA3662047

    Name:
    US8912224, 84

    Mol. Formula:
    C24H21N3O4S

    M.W.:
    447.52

    Type:
    Small molecule

    AlogP:
    5.23

    Polar Surface Area:
    86.48

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  8. ALA3662046

    Name:
    US8912224, 293

    Mol. Formula:
    C27H29N3O3S

    M.W.:
    475.61

    Type:
    Small molecule

    AlogP:
    5.12

    Polar Surface Area:
    72.48

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  9. ALA3662045

    Name:
    US8912224, 108

    Mol. Formula:
    C27H30N2O2S

    M.W.:
    446.62

    Type:
    Small molecule

    AlogP:
    6.62

    Polar Surface Area:
    34.59

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  10. ALA3662044

    Name:
    US8912224, 75

    Mol. Formula:
    C30H28N4O4S

    M.W.:
    540.65

    Type:
    Small molecule

    AlogP:
    5.96

    Polar Surface Area:
    93.65

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  11. ALA3662043

    Name:
    US8912224, 57

    Mol. Formula:
    C19H18N2O2S

    M.W.:
    338.43

    Type:
    Small molecule

    AlogP:
    4.46

    Polar Surface Area:
    57.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  12. ALA3662042

    Name:
    US8912224, 367

    Mol. Formula:
    C22H21FN2O5S

    M.W.:
    444.48

    Type:
    Small molecule

    AlogP:
    3.87

    Polar Surface Area:
    89.91

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  13. ALA3662041

    Name:
    US8912224, 366

    Mol. Formula:
    C24H20FN3O5S

    M.W.:
    481.51

    Type:
    Small molecule

    AlogP:
    5.07

    Polar Surface Area:
    95.71

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  14. ALA3662040

    Name:
    US8912224, 365

    Mol. Formula:
    C26H25FN4O4S

    M.W.:
    508.58

    Type:
    Small molecule

    AlogP:
    5.30

    Polar Surface Area:
    87.50

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  15. ALA3662039

    Name:
    US8912224, 364

    Mol. Formula:
    C22H22N2O4S

    M.W.:
    410.50

    Type:
    Small molecule

    AlogP:
    3.97

    Polar Surface Area:
    80.68

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  16. ALA3662038

    Name:
    US8912224, 363

    Mol. Formula:
    C24H21N3O4S

    M.W.:
    447.52

    Type:
    Small molecule

    AlogP:
    5.17

    Polar Surface Area:
    86.48

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  17. ALA3662037

    Name:
    US8912224, 362

    Mol. Formula:
    C26H25FN4O4S

    M.W.:
    508.58

    Type:
    Small molecule

    AlogP:
    5.30

    Polar Surface Area:
    87.50

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  18. ALA3662036

    Name:
    US8912224, 361

    Mol. Formula:
    C24H20FN3O5S

    M.W.:
    481.51

    Type:
    Small molecule

    AlogP:
    5.07

    Polar Surface Area:
    95.71

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  19. ALA3662035

    Name:
    US8912224, 360

    Mol. Formula:
    C22H21FN2O5S

    M.W.:
    444.48

    Type:
    Small molecule

    AlogP:
    3.87

    Polar Surface Area:
    89.91

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  20. ALA3662034

    Name:
    US8912224, 359

    Mol. Formula:
    C27H28N4O3S

    M.W.:
    488.61

    Type:
    Small molecule

    AlogP:
    5.76

    Polar Surface Area:
    78.27

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
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