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  1. ALA4636971

    Name:
    phenyl (1-(((benzyloxy)carbonyl)amino)-2-methylpropyl)(propyl)phosphinate

    Mol. Formula:
    C21H28NO4P

    M.W.:
    389.43

    Type:
    Unknown

    AlogP:
    5.66

    Polar Surface Area:
    64.63

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  2. ALA4589744

    Name:
    NA

    Mol. Formula:
    C58H92N16O19S2

    M.W.:
    1381.60

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  3. ALA4588591

    Name:
    NA

    Mol. Formula:
    C62H90N16O21S2

    M.W.:
    1459.63

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  4. ALA4560980

    Name:
    NA

    Mol. Formula:
    C61H88N16O21S2

    M.W.:
    1445.60

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  5. ALA4560512

    Name:
    NA

    Mol. Formula:
    C78H100N16O19S2

    M.W.:
    1629.88

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  6. ALA4557877

    Name:
    NA

    Mol. Formula:
    C66H92N16O20S2

    M.W.:
    1493.69

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  7. ALA4528256

    Name:
    NA

    Mol. Formula:
    C59H94N16O19S2

    M.W.:
    1395.63

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  8. ALA4470455

    Name:
    NA

    Mol. Formula:
    C57H90N16O19S2

    M.W.:
    1367.57

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  9. ALA4469546

    Name:
    NA

    Mol. Formula:
    C59H94N16O19S2

    M.W.:
    1395.63

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  10. ALA4467467

    Name:
    NA

    Mol. Formula:
    C68H93N17O19S2

    M.W.:
    1516.73

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  11. ALA4458227

    Name:
    NA

    Mol. Formula:
    C61H88N16O21S2

    M.W.:
    1445.60

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  12. ALA4455694

    Name:
    NA

    Mol. Formula:
    C77H98N16O19S2

    M.W.:
    1615.86

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  13. ALA4449255

    Name:
    NA

    Mol. Formula:
    C56H84N16O22S2

    M.W.:
    1397.51

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  14. ALA4071346

    Name:
    (3S)-4-(1-(bis(4-chlorophenoxy)phosphoryl)butylamino)-3-((S)-3-(4-hydroxyphShow More

    Mol. Formula:
    C44H55Cl2N6O11PS

    M.W.:
    977.90

    Type:
    Small molecule

    AlogP:
    6.15

    Polar Surface Area:
    250.59

    HBA:
    11

    HBD:
    8

    #RO5 Violations:
    4

    #Rotatable Bonds:
    24

    Passes Ro3:
    N

    QED Weighted:
    0.03

    DETAILS
  15. ALA3398163

    Name:
    4-(N-(2-Formylphenyl)sulfamoyl)phenyl 2-methylpropane-2-sulfinate

    Mol. Formula:
    C17H20N2O4S2

    M.W.:
    380.49

    Type:
    Small molecule

    AlogP:
    3.17

    Polar Surface Area:
    98.33

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  16. ALA3398162

    Name:
    4-(N-(2-Acetylphenyl)sulfamoyl)phenyl 2-methylpropane-2-sulfinate

    Mol. Formula:
    C18H22N2O4S2

    M.W.:
    394.52

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    98.33

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  17. ALA3398161

    Name:
    methyl 2-(4-pivalamidophenylsulfonamido)benzoate

    Mol. Formula:
    C19H22N2O5S

    M.W.:
    390.46

    Type:
    Small molecule

    AlogP:
    3.26

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  18. ALA3398160

    Name:
    methyl 2-(4-(3,3,3-trifluoro-2,2-dimethylpropanoyloxy)phenylsulfonamide)benShow More

    Mol. Formula:
    C19H18F3NO6S

    M.W.:
    445.42

    Type:
    Small molecule

    AlogP:
    3.77

    Polar Surface Area:
    98.77

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  19. ALA3398159

    Name:
    Propyl 2-(4-(3,3,3-trifluoro-2,2-dimethylpropanoyloxy)benzamido)benzoate

    Mol. Formula:
    C22H22F3NO5

    M.W.:
    437.41

    Type:
    Small molecule

    AlogP:
    5.00

    Polar Surface Area:
    81.70

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  20. ALA3398158

    Name:
    Ethyl 2-(4-(3,3,3-trifluoro-2,2-dimethylpropanoyloxy)benzamido)benzoate

    Mol. Formula:
    C21H20F3NO5

    M.W.:
    423.39

    Type:
    Small molecule

    AlogP:
    4.61

    Polar Surface Area:
    81.70

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
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