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  1. ALA3670903

    Name:
    US8742158, EX 26

    Mol. Formula:
    C32H49N5O5S

    M.W.:
    615.84

    Type:
    Small molecule

    AlogP:
    4.04

    Polar Surface Area:
    154.72

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  2. ALA3670902

    Name:
    US8742158, EX 25

    Mol. Formula:
    C31H47N5O5S

    M.W.:
    601.81

    Type:
    Small molecule

    AlogP:
    3.73

    Polar Surface Area:
    154.72

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  3. ALA3670901

    Name:
    US8742158, EX 24

    Mol. Formula:
    C27H46N4O6S

    M.W.:
    554.75

    Type:
    Small molecule

    AlogP:
    3.26

    Polar Surface Area:
    151.06

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  4. ALA3670900

    Name:
    US8742158, EX 63

    Mol. Formula:
    C34H46N4O6S

    M.W.:
    638.83

    Type:
    Small molecule

    AlogP:
    3.93

    Polar Surface Area:
    162.06

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  5. ALA3670899

    Name:
    US8742158, EX 23

    Mol. Formula:
    C34H46N4O6S

    M.W.:
    638.83

    Type:
    Small molecule

    AlogP:
    3.93

    Polar Surface Area:
    162.06

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  6. ALA3670898

    Name:
    US8742138, 38::US8742158, EX 22

    Mol. Formula:
    C20H14F3NO6

    M.W.:
    421.33

    Type:
    Small molecule

    AlogP:
    3.39

    Polar Surface Area:
    116.84

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  7. ALA3670897

    Name:
    US8742158, EX 20

    Mol. Formula:
    C32H43N5O5S

    M.W.:
    609.79

    Type:
    Small molecule

    AlogP:
    3.31

    Polar Surface Area:
    154.72

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  8. ALA3670896

    Name:
    US8742158, EX 30

    Mol. Formula:
    C32H42ClN5O5S

    M.W.:
    644.24

    Type:
    Small molecule

    AlogP:
    3.96

    Polar Surface Area:
    154.72

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  9. ALA3670895

    Name:
    US8742158, EX 29

    Mol. Formula:
    C31H40ClN5O5S

    M.W.:
    630.21

    Type:
    Small molecule

    AlogP:
    3.65

    Polar Surface Area:
    154.72

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  10. ALA3639697

    Name:
    US8742158, EX 27

    Mol. Formula:
    C36H44N4O6S

    M.W.:
    660.84

    Type:
    Small molecule

    AlogP:
    5.09

    Polar Surface Area:
    137.93

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  11. ALA3670894

    Name:
    US8742158, EX 35

    Mol. Formula:
    C36H48N4O7S

    M.W.:
    680.87

    Type:
    Small molecule

    AlogP:
    4.37

    Polar Surface Area:
    137.51

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  12. ALA3670893

    Name:
    US8742158, EX 34

    Mol. Formula:
    C38H50N4O7S

    M.W.:
    706.91

    Type:
    Small molecule

    AlogP:
    4.16

    Polar Surface Area:
    137.51

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  13. ALA3670892

    Name:
    US8742158, EX 32

    Mol. Formula:
    C35H47N3O7S

    M.W.:
    653.84

    Type:
    Small molecule

    AlogP:
    4.70

    Polar Surface Area:
    134.27

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  14. ALA3670891

    Name:
    US8742158, EX 31

    Mol. Formula:
    C32H47BrN4O8S

    M.W.:
    727.72

    Type:
    Small molecule

    AlogP:
    3.55

    Polar Surface Area:
    146.74

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  15. ALA3670890

    Name:
    US8742158, EX 17

    Mol. Formula:
    C32H45BrN4O7S

    M.W.:
    709.70

    Type:
    Small molecule

    AlogP:
    3.33

    Polar Surface Area:
    137.51

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  16. ALA3670889

    Name:
    US8742158, EX 16

    Mol. Formula:
    C36H48N4O6S

    M.W.:
    664.87

    Type:
    Small molecule

    AlogP:
    4.88

    Polar Surface Area:
    112.60

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  17. ALA3670888

    Name:
    US8742158, EX 15

    Mol. Formula:
    C36H48N4O5S

    M.W.:
    648.87

    Type:
    Small molecule

    AlogP:
    5.04

    Polar Surface Area:
    103.37

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  18. ALA3670887

    Name:
    US8742158, EX 19

    Mol. Formula:
    C31H40BrN5O6S

    M.W.:
    690.66

    Type:
    Small molecule

    AlogP:
    3.06

    Polar Surface Area:
    174.69

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  19. ALA3670886

    Name:
    US8742158, EX 18

    Mol. Formula:
    C33H43BrN4O6S

    M.W.:
    703.70

    Type:
    Small molecule

    AlogP:
    4.38

    Polar Surface Area:
    162.06

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  20. ALA3670885

    Name:
    US8742158, EX 38

    Mol. Formula:
    C32H42BrN5O6S

    M.W.:
    704.69

    Type:
    Small molecule

    AlogP:
    4.26

    Polar Surface Area:
    163.95

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    17

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
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