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  1. ALA3696474

    Name:
    US9012651, 290

    Mol. Formula:
    C16H18F4N2OS

    M.W.:
    362.39

    Type:
    Small molecule

    AlogP:
    4.07

    Polar Surface Area:
    45.15

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  2. ALA3696473

    Name:
    US9012651, 272

    Mol. Formula:
    C20H20F6N2O

    M.W.:
    418.38

    Type:
    Small molecule

    AlogP:
    5.18

    Polar Surface Area:
    45.15

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  3. ALA3696472

    Name:
    US9012651, 271

    Mol. Formula:
    C20H20F6N2O

    M.W.:
    418.38

    Type:
    Small molecule

    AlogP:
    5.18

    Polar Surface Area:
    45.15

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  4. ALA3696471

    Name:
    US9012651, 262

    Mol. Formula:
    C21H29ClN2O2

    M.W.:
    376.93

    Type:
    Small molecule

    AlogP:
    4.69

    Polar Surface Area:
    54.38

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  5. ALA3696470

    Name:
    US9012651, 242

    Mol. Formula:
    C15H18ClFN2OS

    M.W.:
    328.84

    Type:
    Small molecule

    AlogP:
    3.71

    Polar Surface Area:
    45.15

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  6. ALA3696469

    Name:
    US9012651, 239

    Mol. Formula:
    C19H23F3N2O

    M.W.:
    352.40

    Type:
    Small molecule

    AlogP:
    3.39

    Polar Surface Area:
    45.15

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  7. ALA3696468

    Name:
    US9012651, 234

    Mol. Formula:
    C18H20FN3OS

    M.W.:
    345.44

    Type:
    Small molecule

    AlogP:
    3.60

    Polar Surface Area:
    58.04

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  8. ALA3696467

    Name:
    US9012651, 206

    Mol. Formula:
    C19H31FN2O

    M.W.:
    322.47

    Type:
    Small molecule

    AlogP:
    4.15

    Polar Surface Area:
    45.15

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  9. ALA3696466

    Name:
    US9012651, 197

    Mol. Formula:
    C17H21F3N4O3

    M.W.:
    386.37

    Type:
    Small molecule

    AlogP:
    1.70

    Polar Surface Area:
    100.39

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  10. ALA3696465

    Name:
    US9012651, 170

    Mol. Formula:
    C20H22F3N3O

    M.W.:
    377.41

    Type:
    Small molecule

    AlogP:
    3.66

    Polar Surface Area:
    58.04

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  11. ALA3696464

    Name:
    US9012651, 169

    Mol. Formula:
    C20H22F3N3O

    M.W.:
    377.41

    Type:
    Small molecule

    AlogP:
    3.66

    Polar Surface Area:
    58.04

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  12. ALA3696463

    Name:
    US9012651, 161

    Mol. Formula:
    C19H22F3N3O2

    M.W.:
    381.40

    Type:
    Small molecule

    AlogP:
    3.04

    Polar Surface Area:
    67.27

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  13. ALA3696462

    Name:
    US9012651, 160

    Mol. Formula:
    C17H18F3N3O2

    M.W.:
    353.34

    Type:
    Small molecule

    AlogP:
    2.26

    Polar Surface Area:
    67.27

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  14. ALA3696461

    Name:
    US9012651, 139

    Mol. Formula:
    C20H18F3N3O

    M.W.:
    373.38

    Type:
    Small molecule

    AlogP:
    3.99

    Polar Surface Area:
    58.04

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  15. ALA3696460

    Name:
    US9012651, 130

    Mol. Formula:
    C26H22F4N4O2

    M.W.:
    498.48

    Type:
    Small molecule

    AlogP:
    4.93

    Polar Surface Area:
    87.14

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  16. ALA3696459

    Name:
    US9012651, 129

    Mol. Formula:
    C18H29FN2O

    M.W.:
    308.44

    Type:
    Small molecule

    AlogP:
    3.77

    Polar Surface Area:
    45.15

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  17. ALA3696458

    Name:
    US9012651, 71

    Mol. Formula:
    C19H24FN3O

    M.W.:
    329.42

    Type:
    Small molecule

    AlogP:
    2.85

    Polar Surface Area:
    48.39

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  18. ALA3696457

    Name:
    US9012651, 68

    Mol. Formula:
    C18H21F4N3O2

    M.W.:
    387.38

    Type:
    Small molecule

    AlogP:
    3.33

    Polar Surface Area:
    67.27

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  19. ALA3696456

    Name:
    US9012651, 29

    Mol. Formula:
    C18H18F4N2O

    M.W.:
    354.35

    Type:
    Small molecule

    AlogP:
    3.77

    Polar Surface Area:
    45.15

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  20. ALA3696455

    Name:
    US9012651, 26

    Mol. Formula:
    C16H28N2O2

    M.W.:
    280.41

    Type:
    Small molecule

    AlogP:
    2.76

    Polar Surface Area:
    54.38

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
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