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  1. ALA3856070

    Name:
    SID50111832

    Mol. Formula:
    C11H15BrN2O4S

    M.W.:
    351.22

    Type:
    Small molecule

    AlogP:
    2.63

    Polar Surface Area:
    84.50

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  2. ALA3392483

    Name:
    SID50112175

    Mol. Formula:
    C26H26N2O3S

    M.W.:
    446.57

    Type:
    Small molecule

    AlogP:
    4.02

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  3. ALA3392480

    Name:
    SID50111920

    Mol. Formula:
    C23H26Cl2N2O3S

    M.W.:
    481.45

    Type:
    Small molecule

    AlogP:
    5.13

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  4. ALA3392460

    Name:
    SID50111946

    Mol. Formula:
    C23H27ClN2O3S

    M.W.:
    447.00

    Type:
    Small molecule

    AlogP:
    4.48

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  5. ALA3392447

    Name:
    SID50112208

    Mol. Formula:
    C25H32N2O3S

    M.W.:
    440.61

    Type:
    Small molecule

    AlogP:
    4.26

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  6. ALA3392404

    Name:
    SID50112216

    Mol. Formula:
    C22H24Cl2N2O3S

    M.W.:
    467.42

    Type:
    Small molecule

    AlogP:
    4.74

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  7. 2-Bromo-N-phenethylbenzenesulfonamide

    Name:
    SID50111979

    Mol. Formula:
    C14H14BrNO2S

    M.W.:
    340.24

    Type:
    Small molecule

    AlogP:
    2.97

    Polar Surface Area:
    46.17

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.91

    DETAILS
  8. ALA3392372

    Name:
    SID50112046

    Mol. Formula:
    C26H24Cl2N2O3S

    M.W.:
    515.46

    Type:
    Small molecule

    AlogP:
    5.33

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  9. ALA3392354

    Name:
    SID50112218

    Mol. Formula:
    C26H25ClN2O3S

    M.W.:
    481.02

    Type:
    Small molecule

    AlogP:
    4.68

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  10. ALA3214619

    Name:
    SID24837817

    Mol. Formula:
    C16H20F2N2O3

    M.W.:
    326.34

    Type:
    Small molecule

    AlogP:
    3.09

    Polar Surface Area:
    59.92

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  11. ALA3214528

    Name:
    SID14746804

    Mol. Formula:
    C17H20N4O2S

    M.W.:
    344.44

    Type:
    Small molecule

    AlogP:
    2.06

    Polar Surface Area:
    66.82

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  12. ALA3214491

    Name:
    SID17387297

    Mol. Formula:
    C18H19N3O4

    M.W.:
    341.37

    Type:
    Small molecule

    AlogP:
    2.62

    Polar Surface Area:
    103.01

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  13. ALA3214409

    Name:
    SID14729647

    Mol. Formula:
    C14H10ClF3N2O2

    M.W.:
    330.69

    Type:
    Small molecule

    AlogP:
    3.99

    Polar Surface Area:
    54.71

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  14. ALA3214261

    Name:
    SID17386713

    Mol. Formula:
    C18H17N5O5

    M.W.:
    383.36

    Type:
    Small molecule

    AlogP:
    2.60

    Polar Surface Area:
    124.79

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  15. ALA3214259

    Name:
    SID24824071

    Mol. Formula:
    C22H26N4O6S

    M.W.:
    474.54

    Type:
    Small molecule

    AlogP:
    0.99

    Polar Surface Area:
    126.40

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  16. ALA3214161

    Name:
    SID49819015

    Mol. Formula:
    C18H17N3O4

    M.W.:
    339.35

    Type:
    Small molecule

    AlogP:
    2.28

    Polar Surface Area:
    89.02

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  17. ALA3214153

    Name:
    SID24782618

    Mol. Formula:
    C16H22N4O2

    M.W.:
    302.38

    Type:
    Small molecule

    AlogP:
    1.76

    Polar Surface Area:
    83.45

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  18. ALA3214049

    Name:
    SID17413033

    Mol. Formula:
    C14H12ClNO2

    M.W.:
    261.71

    Type:
    Small molecule

    AlogP:
    3.73

    Polar Surface Area:
    41.82

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  19. ALA3213976

    Name:
    SID49823684

    Mol. Formula:
    C25H22N4O2

    M.W.:
    410.48

    Type:
    Small molecule

    AlogP:
    4.85

    Polar Surface Area:
    76.47

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  20. ALA3213931

    Name:
    SID844704

    Mol. Formula:
    C14H15Cl2N3O3S

    M.W.:
    376.27

    Type:
    Small molecule

    AlogP:
    2.79

    Polar Surface Area:
    82.00

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
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