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  1. ALA4483639

    Name:
    (1S,3aR,3bR,5aR,10aR,10bR,12R,12aR)-8-Amino-12-hyd
    Show More

    Mol. Formula:
    C31H48N2O3S

    M.W.:
    528.80

    Type:
    Unknown

    AlogP:
    6.31

    Polar Surface Area:
    85.44

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  2. ALA4476322

    Name:
    (1S,3aR,3bR,5S,5aR,11aR,11bR,13R,13aR)-3a,3b,6,6,1
    Show More

    Mol. Formula:
    C32H50N2O3

    M.W.:
    510.76

    Type:
    Unknown

    AlogP:
    5.85

    Polar Surface Area:
    75.47

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  3. ALA4475180

    Name:
    (1S,3aR,3bR,5R,5aR,10aR,10bR,12R,12aR)-9-Hydroxyme
    Show More

    Mol. Formula:
    C32H51NO5

    M.W.:
    529.76

    Type:
    Unknown

    AlogP:
    5.55

    Polar Surface Area:
    95.95

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  4. ALA4540586

    Name:
    (1S,3aR,3bR,5R,5aR,10aR,10bR,12R,12aR)-3a,3b,6,6,1
    Show More

    Mol. Formula:
    C31H50N2O3

    M.W.:
    498.75

    Type:
    Unknown

    AlogP:
    5.79

    Polar Surface Area:
    78.37

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  5. ALA4537930

    Name:
    (1S,3aR,3bR,5R,5aR,10aR,10bR,12R,12aR)-3a,3b,6,6,1
    Show More

    Mol. Formula:
    C32H49F3N2O3

    M.W.:
    566.75

    Type:
    Unknown

    AlogP:
    6.81

    Polar Surface Area:
    78.37

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  6. ALA4532494

    Name:
    NA

    Mol. Formula:
    C34H51NO5S

    M.W.:
    585.85

    Type:
    Unknown

    AlogP:
    6.91

    Polar Surface Area:
    85.72

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  7. ALA4552137

    Name:
    NA

    Mol. Formula:
    C38H56N2O4

    M.W.:
    604.88

    Type:
    Unknown

    AlogP:
    6.74

    Polar Surface Area:
    87.74

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  8. ALA4529496

    Name:
    NA

    Mol. Formula:
    C34H54N2O5

    M.W.:
    570.82

    Type:
    Unknown

    AlogP:
    5.96

    Polar Surface Area:
    104.67

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  9. ALA4528526

    Name:
    NA

    Mol. Formula:
    C40H58N2O5

    M.W.:
    646.91

    Type:
    Unknown

    AlogP:
    7.43

    Polar Surface Area:
    93.81

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  10. ALA4515114

    Name:
    (1S,3aR,3bR,5aR,10aR,10bR,12R,12aR)-12-Hydroxy-3a,
    Show More

    Mol. Formula:
    C32H50N2O3S

    M.W.:
    542.83

    Type:
    Unknown

    AlogP:
    6.77

    Polar Surface Area:
    71.45

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  11. ALA4581114

    Name:
    (1S,3aR,3bR,5aR,10aR,10bR,12R,12aR)-12-Hydroxy-3a,
    Show More

    Mol. Formula:
    C37H52N2O3S

    M.W.:
    604.90

    Type:
    Unknown

    AlogP:
    8.47

    Polar Surface Area:
    71.45

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  12. ALA4586134

    Name:
    NA

    Mol. Formula:
    C38H53NO4S

    M.W.:
    619.91

    Type:
    Unknown

    AlogP:
    8.41

    Polar Surface Area:
    68.65

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  13. ALA4463965

    Name:
    NA

    Mol. Formula:
    C36H52N2O5S

    M.W.:
    624.89

    Type:
    Unknown

    AlogP:
    6.40

    Polar Surface Area:
    122.48

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  14. ALA4461804

    Name:
    NA

    Mol. Formula:
    C36H50FNO3

    M.W.:
    563.80

    Type:
    Unknown

    AlogP:
    7.89

    Polar Surface Area:
    62.32

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  15. ALA4464467

    Name:
    (1S,3aR,3bR,5R,5aR,10aR,10bR,12R,12aR)-3a,3b,6,6,1
    Show More

    Mol. Formula:
    C31H49NO4

    M.W.:
    499.74

    Type:
    Unknown

    AlogP:
    6.05

    Polar Surface Area:
    75.72

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  16. ALA4472491

    Name:
    (1S,3aR,3bR,5aR,10aR,10bR,12R,12aR)-12-Hydroxy-8-i
    Show More

    Mol. Formula:
    C34H53NO3S

    M.W.:
    555.87

    Type:
    Unknown

    AlogP:
    7.85

    Polar Surface Area:
    59.42

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  17. ALA4471696

    Name:
    NA

    Mol. Formula:
    C37H53NO4

    M.W.:
    575.83

    Type:
    Unknown

    AlogP:
    7.76

    Polar Surface Area:
    71.55

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  18. ALA4473465

    Name:
    (1S,3aR,3bR,5aR,10aR,10bR,12R,12aR)-8-Bromo-12-hyd
    Show More

    Mol. Formula:
    C31H46BrNO3S

    M.W.:
    592.68

    Type:
    Unknown

    AlogP:
    7.49

    Polar Surface Area:
    59.42

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  19. ALA4566357

    Name:
    NA

    Mol. Formula:
    C36H50ClNO3

    M.W.:
    580.25

    Type:
    Unknown

    AlogP:
    8.41

    Polar Surface Area:
    62.32

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  20. ALA4587178

    Name:
    NA

    Mol. Formula:
    C36H49ClFNO3

    M.W.:
    598.24

    Type:
    Unknown

    AlogP:
    8.55

    Polar Surface Area:
    62.32

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
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