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  1. ALA3197182

    Name:
    SID17413471

    Mol. Formula:
    C14H11BrFNO2

    M.W.:
    324.15

    Type:
    Small molecule

    AlogP:
    3.98

    Polar Surface Area:
    41.82

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  2. ALA1902933

    Name:
    SID92764411

    Mol. Formula:
    C12H11NO2S2

    M.W.:
    265.36

    Type:
    Small molecule

    AlogP:
    2.57

    Polar Surface Area:
    38.33

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  3. ALA1894226

    Name:
    SID92763365

    Mol. Formula:
    C14H29NO2

    M.W.:
    243.39

    Type:
    Small molecule

    AlogP:
    4.19

    Polar Surface Area:
    49.33

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  4. ALA1882953

    Name:
    SID85200204

    Mol. Formula:
    C14H11FN2O6

    M.W.:
    322.25

    Type:
    Small molecule

    AlogP:
    1.80

    Polar Surface Area:
    111.68

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  5. ALA1881729

    Name:
    SID57256482

    Mol. Formula:
    C22H20ClN3O6S

    M.W.:
    489.94

    Type:
    Small molecule

    AlogP:
    2.95

    Polar Surface Area:
    125.04

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  6. ALA1877591

    Name:
    SID89853986

    Mol. Formula:
    C22H21NO2

    M.W.:
    331.42

    Type:
    Small molecule

    AlogP:
    3.94

    Polar Surface Area:
    43.70

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  7. ALA1877472

    Name:
    SID89850945

    Mol. Formula:
    C17H17NO2

    M.W.:
    267.33

    Type:
    Small molecule

    AlogP:
    3.46

    Polar Surface Area:
    47.03

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  8. ALA1870867

    Name:
    SID47195308

    Mol. Formula:
    C17H24ClN3O3

    M.W.:
    353.85

    Type:
    Small molecule

    AlogP:
    4.99

    Polar Surface Area:
    17.82

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  9. ALA1867881

    Name:
    SID89855491

    Mol. Formula:
    C20H28N2O

    M.W.:
    312.46

    Type:
    Small molecule

    AlogP:
    3.98

    Polar Surface Area:
    44.95

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
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