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  1. ALA3189035

    Name:
    SID104223814

    Mol. Formula:
    C9H3ClN4O4

    M.W.:
    266.60

    Type:
    Small molecule

    AlogP:
    1.41

    Polar Surface Area:
    119.90

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  2. ALA3188649

    Name:
    SID103061628

    Mol. Formula:
    C19H18N6OS

    M.W.:
    378.46

    Type:
    Small molecule

    AlogP:
    2.46

    Polar Surface Area:
    74.56

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  3. ALA3188444

    Name:
    SID104223903

    Mol. Formula:
    C22H15ClN2O4S

    M.W.:
    438.89

    Type:
    Small molecule

    AlogP:
    5.07

    Polar Surface Area:
    79.61

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  4. ALA3187969

    Name:
    SID104223914

    Mol. Formula:
    C24H17ClN6O4

    M.W.:
    488.89

    Type:
    Small molecule

    AlogP:
    2.87

    Polar Surface Area:
    136.33

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  5. ALA3186918

    Name:
    SID104224158

    Mol. Formula:
    C21H14ClN5O2S

    M.W.:
    435.90

    Type:
    Small molecule

    AlogP:
    5.33

    Polar Surface Area:
    85.32

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  6. ALA3184310

    Name:
    SID104223901

    Mol. Formula:
    C22H15ClN2O4S

    M.W.:
    438.89

    Type:
    Small molecule

    AlogP:
    5.07

    Polar Surface Area:
    79.61

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  7. ALA3183925

    Name:
    SID104223916

    Mol. Formula:
    C24H17FN6O4

    M.W.:
    472.44

    Type:
    Small molecule

    AlogP:
    2.36

    Polar Surface Area:
    136.33

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  8. ALA3181855

    Name:
    SID104223913

    Mol. Formula:
    C24H17FN6O4

    M.W.:
    472.44

    Type:
    Small molecule

    AlogP:
    2.36

    Polar Surface Area:
    136.33

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  9. ALA2143550

    Name:
    SID93577437

    Mol. Formula:
    C11H11FN2OS

    M.W.:
    238.29

    Type:
    Small molecule

    AlogP:
    1.68

    Polar Surface Area:
    32.34

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    Y

    QED Weighted:
    0.76

    DETAILS
  10. ALA2142839

    Name:
    SID57268011

    Mol. Formula:
    C21H19N3O8S2

    M.W.:
    505.53

    Type:
    Small molecule

    AlogP:
    3.04

    Polar Surface Area:
    145.15

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  11. ALA2141816

    Name:
    SID57262035

    Mol. Formula:
    C24H29ClN2O9S

    M.W.:
    557.02

    Type:
    Small molecule

    AlogP:
    2.50

    Polar Surface Area:
    129.70

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  12. ALA2140919

    Name:
    SID49826995

    Mol. Formula:
    C19H26N2O4S

    M.W.:
    378.49

    Type:
    Small molecule

    AlogP:
    2.27

    Polar Surface Area:
    59.08

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  13. ALA2140637

    Name:
    SID93577147

    Mol. Formula:
    C10H12FN2O5P

    M.W.:
    290.19

    Type:
    Small molecule

    AlogP:
    2.43

    Polar Surface Area:
    90.70

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  14. ALA2139637

    Name:
    SID49672553

    Mol. Formula:
    C15H18N2O4S

    M.W.:
    322.39

    Type:
    Small molecule

    AlogP:
    1.52

    Polar Surface Area:
    102.40

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  15. ALA2139300

    Name:
    SID89853750

    Mol. Formula:
    C15H18O4

    M.W.:
    262.30

    Type:
    Small molecule

    AlogP:
    2.60

    Polar Surface Area:
    44.76

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  16. ALA2138803

    Name:
    SID49729043

    Mol. Formula:
    C12H11NO3S2

    M.W.:
    281.36

    Type:
    Small molecule

    AlogP:
    2.28

    Polar Surface Area:
    55.40

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.86

    DETAILS
  17. ALA2138095

    Name:
    SID49822108

    Mol. Formula:
    C20H24FNO4

    M.W.:
    361.41

    Type:
    Small molecule

    AlogP:
    3.14

    Polar Surface Area:
    56.79

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  18. ALA2137122

    Name:
    SID49822097

    Mol. Formula:
    C17H17N3O5S2

    M.W.:
    407.47

    Type:
    Small molecule

    AlogP:
    2.48

    Polar Surface Area:
    110.53

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  19. ALA2136883

    Name:
    SID124754729

    Mol. Formula:
    C17H17N3O3S

    M.W.:
    343.41

    Type:
    Small molecule

    AlogP:
    3.34

    Polar Surface Area:
    87.33

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  20. ALA2136611

    Name:
    SID49732726

    Mol. Formula:
    C18H19N5O4S2

    M.W.:
    433.52

    Type:
    Small molecule

    AlogP:
    2.92

    Polar Surface Area:
    127.08

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
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