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  1. ALA2062290

    Name:
    SB-739245-AC

    Mol. Formula:
    C23H28BrN5O7S

    M.W.:
    598.48

    Type:
    Small molecule

    AlogP:
    4.51

    Polar Surface Area:
    73.91

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  2. ALA2062289

    Name:
    SB-698596-AC

    Mol. Formula:
    C24H28F2N6O7

    M.W.:
    550.52

    Type:
    Small molecule

    AlogP:
    3.36

    Polar Surface Area:
    86.80

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  3. ALA1909415

    Name:
    GW693881A

    Mol. Formula:
    C23H17Cl2FN4OS

    M.W.:
    487.39

    Type:
    Small molecule

    AlogP:
    6.80

    Polar Surface Area:
    62.83

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  4. ALA1909414

    Name:
    SB-590885-AAD

    Mol. Formula:
    C27H30ClN5O3

    M.W.:
    508.02

    Type:
    Small molecule

    AlogP:
    4.87

    Polar Surface Area:
    86.63

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  5. ALA1909413

    Name:
    SB-610251-B

    Mol. Formula:
    C20H16ClN3O

    M.W.:
    349.82

    Type:
    Small molecule

    AlogP:
    4.51

    Polar Surface Area:
    61.80

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  6. ALA1909412

    Name:
    SB-476429-A

    Mol. Formula:
    C21H18Cl2N4O

    M.W.:
    413.31

    Type:
    Small molecule

    AlogP:
    4.62

    Polar Surface Area:
    87.82

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  7. ALA1909411

    Name:
    GI261520A

    Cas Number:
    179246-79-8

    Mol. Formula:
    C22H20ClN3O2

    M.W.:
    393.87

    Type:
    Small molecule

    AlogP:
    4.96

    Polar Surface Area:
    56.27

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  8. ALA1909410

    Name:
    GSK259178A

    Mol. Formula:
    C34H29F5N6O5S

    M.W.:
    728.70

    Type:
    Small molecule

    AlogP:
    5.27

    Polar Surface Area:
    93.54

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  9. ALA1909409

    Name:
    GSK238583A

    Mol. Formula:
    C32H30F3N5O5S

    M.W.:
    653.68

    Type:
    Small molecule

    AlogP:
    4.58

    Polar Surface Area:
    88.61

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  10. ALA1909408

    Name:
    GSK200398A

    Mol. Formula:
    C31H30ClN7O3S

    M.W.:
    616.15

    Type:
    Small molecule

    AlogP:
    4.38

    Polar Surface Area:
    106.43

    HBA:
    10

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  11. ALA1909407

    Name:
    SB-220025-A

    Mol. Formula:
    C18H20ClFN6

    M.W.:
    374.85

    Type:
    Small molecule

    AlogP:
    2.65

    Polar Surface Area:
    81.65

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  12. ALA1909406

    Name:
    SKF-86002-A2

    Mol. Formula:
    C16H13ClFN3S

    M.W.:
    333.82

    Type:
    Small molecule

    AlogP:
    3.86

    Polar Surface Area:
    30.71

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  13. ALA1909405

    Name:
    GW618013A

    Mol. Formula:
    C24H26F4N6O3S

    M.W.:
    554.57

    Type:
    Small molecule

    AlogP:
    4.98

    Polar Surface Area:
    58.35

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  14. ALA1909403

    Name:
    GW569293E

    Mol. Formula:
    C25H21F4N5O5

    M.W.:
    547.47

    Type:
    Small molecule

    AlogP:
    4.41

    Polar Surface Area:
    75.34

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  15. ALA1909401

    Name:
    SB-285234-W

    Mol. Formula:
    C25H21FLiN5O3

    M.W.:
    465.41

    Type:
    Small molecule

    AlogP:
    4.56

    Polar Surface Area:
    102.16

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  16. ALA1909400

    Name:
    SB-284847-BT

    Mol. Formula:
    C28H27F4N5O3

    M.W.:
    557.55

    Type:
    Small molecule

    AlogP:
    5.48

    Polar Surface Area:
    64.86

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  17. ALA1909399

    Name:
    GW352430A

    Mol. Formula:
    C21H20ClN5O3S

    M.W.:
    457.94

    Type:
    Small molecule

    AlogP:
    2.28

    Polar Surface Area:
    126.54

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  18. ALA1909397

    Name:
    GW279320X

    Mol. Formula:
    C15H13ClN4O3S

    M.W.:
    364.81

    Type:
    Small molecule

    AlogP:
    2.06

    Polar Surface Area:
    113.65

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  19. ALA1909396

    Name:
    GW768505A

    Cas Number:
    501693-25-0

    Mol. Formula:
    C27H20ClF4N5O3

    M.W.:
    573.93

    Type:
    Small molecule

    AlogP:
    6.95

    Polar Surface Area:
    115.30

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  20. ALA1909395

    Name:
    GW633459A

    Mol. Formula:
    C34H29Cl2FN4O4S

    M.W.:
    679.60

    Type:
    Small molecule

    AlogP:
    7.57

    Polar Surface Area:
    106.35

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
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