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  1. ALA3647949

    Name:
    US8476255, 101

    Mol. Formula:
    C22H25N3O4

    M.W.:
    395.46

    Type:
    Small molecule

    AlogP:
    3.12

    Polar Surface Area:
    107.53

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  2. ALA3647948

    Name:
    US8476255, 96

    Mol. Formula:
    C23H28N2O3S

    M.W.:
    412.56

    Type:
    Small molecule

    AlogP:
    4.44

    Polar Surface Area:
    78.43

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  3. ALA3647947

    Name:
    US8476255, 95

    Mol. Formula:
    C22H25ClN2O3S

    M.W.:
    432.97

    Type:
    Small molecule

    AlogP:
    4.78

    Polar Surface Area:
    78.43

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  4. ALA3647946

    Name:
    US8476255, 94

    Mol. Formula:
    C22H25FN2O3S

    M.W.:
    416.52

    Type:
    Small molecule

    AlogP:
    4.27

    Polar Surface Area:
    78.43

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  5. ALA3647945

    Name:
    US8476255, 92

    Mol. Formula:
    C23H28N2O4S

    M.W.:
    428.55

    Type:
    Small molecule

    AlogP:
    4.14

    Polar Surface Area:
    87.66

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  6. ALA3647944

    Name:
    US8476255, 90

    Mol. Formula:
    C20H24N2O3S2

    M.W.:
    404.56

    Type:
    Small molecule

    AlogP:
    4.19

    Polar Surface Area:
    78.43

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  7. ALA3647943

    Name:
    US8476255, 89

    Mol. Formula:
    C21H20F4N2O3

    M.W.:
    424.39

    Type:
    Small molecule

    AlogP:
    3.97

    Polar Surface Area:
    78.43

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  8. ALA3647942

    Name:
    US8476255, 85

    Mol. Formula:
    C22H26N2O3

    M.W.:
    366.46

    Type:
    Small molecule

    AlogP:
    3.80

    Polar Surface Area:
    78.43

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  9. ALA3647941

    Name:
    US8476255, 84

    Mol. Formula:
    C23H27FN2O3S

    M.W.:
    430.55

    Type:
    Small molecule

    AlogP:
    4.66

    Polar Surface Area:
    78.43

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  10. ALA3647940

    Name:
    US8476255, 77

    Mol. Formula:
    C27H25FN2O5

    M.W.:
    476.50

    Type:
    Small molecule

    AlogP:
    4.22

    Polar Surface Area:
    96.89

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  11. ALA3647939

    Name:
    BOC-LYS(AC)-AMC::US8476255, 76

    Mol. Formula:
    C26H23FN2O3S

    M.W.:
    462.55

    Type:
    Small molecule

    AlogP:
    4.92

    Polar Surface Area:
    78.43

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
  12. ALA3647938

    Name:
    US8476255, 59

    Mol. Formula:
    C22H20N2O3S2

    M.W.:
    424.55

    Type:
    Small molecule

    AlogP:
    4.45

    Polar Surface Area:
    78.43

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  13. ALA3647937

    Name:
    US8476255, 58

    Mol. Formula:
    C25H24N2O3S

    M.W.:
    432.55

    Type:
    Small molecule

    AlogP:
    4.69

    Polar Surface Area:
    78.43

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  14. ALA3647936

    Name:
    US8476255, 57

    Mol. Formula:
    C25H24N2O4S

    M.W.:
    448.54

    Type:
    Small molecule

    AlogP:
    4.39

    Polar Surface Area:
    87.66

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  15. ALA3647935

    Name:
    US8476255, 55

    Mol. Formula:
    C23H21N3O3S

    M.W.:
    419.51

    Type:
    Small molecule

    AlogP:
    3.78

    Polar Surface Area:
    91.32

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  16. ALA3647934

    Name:
    US8476255, 53

    Mol. Formula:
    C24H21FN2O4

    M.W.:
    420.44

    Type:
    Small molecule

    AlogP:
    3.81

    Polar Surface Area:
    87.66

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  17. ALA3644954

    Name:
    US8476255, 52

    Mol. Formula:
    C24H21FN2O3S

    M.W.:
    436.51

    Type:
    Small molecule

    AlogP:
    4.52

    Polar Surface Area:
    78.43

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  18. ALA3644953

    Name:
    US8476255, 49

    Mol. Formula:
    C24H21FN2O4

    M.W.:
    420.44

    Type:
    Small molecule

    AlogP:
    3.81

    Polar Surface Area:
    87.66

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  19. ALA3644952

    Name:
    US8476255, 37

    Mol. Formula:
    C29H27N3O4S

    M.W.:
    513.62

    Type:
    Small molecule

    AlogP:
    5.46

    Polar Surface Area:
    102.68

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  20. ALA3644951

    Name:
    US8476255, 33

    Mol. Formula:
    C31H26ClN3O4

    M.W.:
    540.02

    Type:
    Small molecule

    AlogP:
    5.82

    Polar Surface Area:
    110.52

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
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