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  1. ALA3214432

    Name:
    SID24816061

    Mol. Formula:
    C18H22N2O4S

    M.W.:
    362.45

    Type:
    Small molecule

    AlogP:
    3.10

    Polar Surface Area:
    69.89

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  2. ALA3210223

    Name:
    SID17409579

    Mol. Formula:
    C17H14F3N5O2S

    M.W.:
    409.39

    Type:
    Small molecule

    AlogP:
    3.43

    Polar Surface Area:
    81.40

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  3. ALA3209698

    Name:
    SID14739241

    Mol. Formula:
    C16H11ClN2O2S2

    M.W.:
    362.86

    Type:
    Small molecule

    AlogP:
    3.80

    Polar Surface Area:
    43.59

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  4. ALA3209573

    Name:
    SID22400811

    Mol. Formula:
    C16H15Cl2N3O4S3

    M.W.:
    480.42

    Type:
    Small molecule

    AlogP:
    3.50

    Polar Surface Area:
    103.75

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  5. ALA3209557

    Name:
    SID14741583

    Mol. Formula:
    C24H21N3O4S

    M.W.:
    447.52

    Type:
    Small molecule

    AlogP:
    1.27

    Polar Surface Area:
    84.56

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  6. ALA3208768

    Name:
    SID7975560

    Mol. Formula:
    C15H20N4O2S

    M.W.:
    320.42

    Type:
    Small molecule

    AlogP:
    2.76

    Polar Surface Area:
    58.03

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  7. ALA3208420

    Name:
    SID22400865

    Mol. Formula:
    C20H16ClN3O5S3

    M.W.:
    510.02

    Type:
    Small molecule

    AlogP:
    3.52

    Polar Surface Area:
    120.82

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  8. ALA3207839

    Name:
    SID24816355

    Mol. Formula:
    C17H16N2O3S

    M.W.:
    328.39

    Type:
    Small molecule

    AlogP:
    3.00

    Polar Surface Area:
    52.82

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  9. ALA3197880

    Name:
    SID22404424

    Mol. Formula:
    C12H10FN5O3

    M.W.:
    291.24

    Type:
    Small molecule

    AlogP:
    1.23

    Polar Surface Area:
    102.42

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  10. ALA3195801

    Name:
    SID3713858

    Mol. Formula:
    C18H22N2O6S

    M.W.:
    394.45

    Type:
    Small molecule

    AlogP:
    2.34

    Polar Surface Area:
    88.35

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  11. ALA3195359

    Name:
    SID22414486

    Mol. Formula:
    C19H24N2O

    M.W.:
    296.41

    Type:
    Small molecule

    AlogP:
    4.61

    Polar Surface Area:
    35.83

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  12. ALA3194630

    Name:
    SID24826684

    Mol. Formula:
    C14H10BrN3OS

    M.W.:
    348.23

    Type:
    Small molecule

    AlogP:
    4.61

    Polar Surface Area:
    50.42

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  13. ALA3194048

    Name:
    SID24828847

    Mol. Formula:
    C18H17N3OS

    M.W.:
    323.42

    Type:
    Small molecule

    AlogP:
    4.12

    Polar Surface Area:
    39.41

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  14. ALA3193904

    Name:
    SID24822825

    Mol. Formula:
    C15H12BrN3O4

    M.W.:
    378.18

    Type:
    Small molecule

    AlogP:
    3.13

    Polar Surface Area:
    93.83

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  15. ALA3192152

    Name:
    SID24791916

    Mol. Formula:
    C13H10BrN3S2

    M.W.:
    352.28

    Type:
    Small molecule

    AlogP:
    4.96

    Polar Surface Area:
    37.28

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  16. ALA3191374

    Name:
    SID17409700

    Mol. Formula:
    C15H12ClFN2OS

    M.W.:
    322.79

    Type:
    Small molecule

    AlogP:
    4.55

    Polar Surface Area:
    45.38

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  17. ALA3190678

    Name:
    SID24790936

    Mol. Formula:
    C9H9N5OS

    M.W.:
    235.27

    Type:
    Small molecule

    AlogP:
    1.39

    Polar Surface Area:
    83.29

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  18. ALA3190105

    Name:
    SID22414192

    Mol. Formula:
    C16H14N4OS

    M.W.:
    310.38

    Type:
    Small molecule

    AlogP:
    3.21

    Polar Surface Area:
    70.14

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  19. ALA3189704

    Name:
    SID24817815

    Mol. Formula:
    C16H17ClN4OS

    M.W.:
    348.86

    Type:
    Small molecule

    AlogP:
    3.55

    Polar Surface Area:
    57.59

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  20. ALA3189578

    Name:
    SID24805083

    Mol. Formula:
    C11H9BrN2O2S

    M.W.:
    313.18

    Type:
    Small molecule

    AlogP:
    3.18

    Polar Surface Area:
    54.60

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
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