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  1. ALA4757291

    Name:
    Cholestene-7alpha-trifluoromethyl,3beta,7beta,25-t
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    Mol. Formula:
    C28H45F3O3

    M.W.:
    486.66

    Type:
    Unknown

    AlogP:
    6.41

    Polar Surface Area:
    60.69

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  2. ALA4776911

    Name:
    (3S,7R,8S,9R,10R,13R,14S)-17-((2R)-7-hydroxy-6-met
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    Mol. Formula:
    C27H46O3

    M.W.:
    418.66

    Type:
    Unknown

    AlogP:
    5.33

    Polar Surface Area:
    60.69

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  3. ALA4779254

    Name:
    Cholestene-7beta-trifluoromethyl,3beta,7alpha,25-t
    Show More

    Mol. Formula:
    C28H45F3O3

    M.W.:
    486.66

    Type:
    Unknown

    AlogP:
    6.41

    Polar Surface Area:
    60.69

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  4. Type:
    Unknown

    AlogP:
    5.33

    Polar Surface Area:
    60.69

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  5. ALA3561875

    Name:
    SID174315876

    Mol. Formula:
    C18H18BrClN2O

    M.W.:
    393.71

    Type:
    Small molecule

    AlogP:
    4.06

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  6. ALA3561867

    Name:
    SID174315862

    Mol. Formula:
    C20H18BrF3N2O3S

    M.W.:
    503.34

    Type:
    Small molecule

    AlogP:
    4.01

    Polar Surface Area:
    57.69

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  7. ALA3561862

    Name:
    SID174315878

    Mol. Formula:
    C18H16BrClN2O2

    M.W.:
    407.70

    Type:
    Small molecule

    AlogP:
    3.70

    Polar Surface Area:
    40.62

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  8. ALA3561859

    Name:
    SID162009964

    Mol. Formula:
    C19H18BrFN2O3S

    M.W.:
    453.33

    Type:
    Small molecule

    AlogP:
    3.13

    Polar Surface Area:
    57.69

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  9. ALA3561833

    Name:
    SID162009886

    Mol. Formula:
    C22H25FN2O3S

    M.W.:
    416.52

    Type:
    Small molecule

    AlogP:
    3.32

    Polar Surface Area:
    57.69

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  10. ALA3561800

    Name:
    SID162009941

    Mol. Formula:
    C21H23ClN2O3

    M.W.:
    386.88

    Type:
    Small molecule

    AlogP:
    3.70

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  11. ALA3561798

    Name:
    SID174315884

    Mol. Formula:
    C17H23BrN2O

    M.W.:
    351.29

    Type:
    Small molecule

    AlogP:
    3.41

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  12. ALA3561756

    Name:
    SID174315886

    Mol. Formula:
    C21H22BrFN2O

    M.W.:
    417.32

    Type:
    Small molecule

    AlogP:
    4.25

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  13. ALA3561739

    Name:
    SID174315857

    Mol. Formula:
    C21H19BrF4N2O

    M.W.:
    471.29

    Type:
    Small molecule

    AlogP:
    4.96

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  14. ALA3561719

    Name:
    SID174315871

    Mol. Formula:
    C23H27BrN2O

    M.W.:
    427.39

    Type:
    Small molecule

    AlogP:
    4.93

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  15. ALA3561698

    Name:
    SID162009880

    Mol. Formula:
    C19H17Cl2FN2O3S

    M.W.:
    443.33

    Type:
    Small molecule

    AlogP:
    3.68

    Polar Surface Area:
    57.69

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  16. ALA3561640

    Name:
    SID162009937

    Mol. Formula:
    C21H23FN2O3

    M.W.:
    370.42

    Type:
    Small molecule

    AlogP:
    3.18

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  17. ALA3561595

    Name:
    SID174315866

    Mol. Formula:
    C19H18ClFN2O3S

    M.W.:
    408.88

    Type:
    Small molecule

    AlogP:
    3.03

    Polar Surface Area:
    57.69

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  18. ALA3561498

    Name:
    SID162009883

    Mol. Formula:
    C19H18F2N2O3S

    M.W.:
    392.43

    Type:
    Small molecule

    AlogP:
    2.51

    Polar Surface Area:
    57.69

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  19. ALA3561495

    Name:
    SID174315858

    Mol. Formula:
    C21H19BrClF3N2O

    M.W.:
    487.75

    Type:
    Small molecule

    AlogP:
    5.48

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  20. ALA3561484

    Name:
    SID174315881

    Mol. Formula:
    C20H19BrClFN2O

    M.W.:
    437.74

    Type:
    Small molecule

    AlogP:
    4.60

    Polar Surface Area:
    23.55

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
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