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Items 1-20 of 135

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  1. ALA5091899

    Name:
    N-(4-fluorophenyl)-2-(3-oxo-1,1-diphenyldihydro-1H
    Show More

    Mol. Formula:
    C26H24FN3O3

    M.W.:
    445.49

    Type:
    Unknown

    AlogP:
    3.84

    Polar Surface Area:
    61.88

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  2. ALA5091859

    Name:
    N-(4-fluorobenzyl)-3-oxo-1,1-diphenyltetrahydro-1H
    Show More

    Mol. Formula:
    C26H25FN4O2

    M.W.:
    444.51

    Type:
    Unknown

    AlogP:
    3.93

    Polar Surface Area:
    68.66

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  3. ALA5089610

    Name:
    (5S,8aR)-5-sec-butyl-N-(4-fluorobenzyl)-3-oxo-1,1-
    Show More

    Mol. Formula:
    C30H32FN3O3

    M.W.:
    501.60

    Type:
    Unknown

    AlogP:
    5.53

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  4. ALA5088829

    Name:
    N-(4-fluorobenzyl)-2-(3-oxo-1,1-diphenyldihydro-1H
    Show More

    Mol. Formula:
    C27H26FN3O3

    M.W.:
    459.52

    Type:
    Unknown

    AlogP:
    3.52

    Polar Surface Area:
    61.88

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  5. ALA5088233

    Name:
    N-(4-fluorobenzyl)-3-oxo-1,1-dio-tolyltetrahydro-1
    Show More

    Mol. Formula:
    C28H28FN3O3

    M.W.:
    473.55

    Type:
    Unknown

    AlogP:
    4.73

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  6. ALA5087620

    Name:
    (5S,8aR)-N-(4-fluorobenzyl)-5-isopropyl-3-oxo-1,1-
    Show More

    Mol. Formula:
    C29H30FN3O3

    M.W.:
    487.58

    Type:
    Unknown

    AlogP:
    5.14

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  7. ALA5086131

    Name:
    N-(4-fluorobenzyl)-1,1-bis(2-methoxyphenyl)-3-oxot
    Show More

    Mol. Formula:
    C28H28FN3O5

    M.W.:
    505.55

    Type:
    Unknown

    AlogP:
    4.13

    Polar Surface Area:
    80.34

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  8. ALA5085031

    Name:
    N-(4-fluorobenzyl)-3-oxo-1,1-dip-tolyltetrahydro-1
    Show More

    Mol. Formula:
    C28H28FN3O3

    M.W.:
    473.55

    Type:
    Unknown

    AlogP:
    4.73

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  9. ALA5084360

    Name:
    1,1-bis(4-(dimethylamino)phenyl)-N-(4-fluorobenzyl
    Show More

    Mol. Formula:
    C30H34FN5O3

    M.W.:
    531.63

    Type:
    Unknown

    AlogP:
    4.25

    Polar Surface Area:
    68.36

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  10. ALA5084046

    Name:
    1,1-bis(4-chlorophenyl)-N-(4-fluorobenzyl)-3-oxote
    Show More

    Mol. Formula:
    C26H22Cl2FN3O3

    M.W.:
    514.38

    Type:
    Unknown

    AlogP:
    5.42

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  11. ALA5082363

    Name:
    N-(4-fluorobenzyl)-3'-oxotetrahydrospiro[cyclohexa
    Show More

    Mol. Formula:
    C19H24FN3O3

    M.W.:
    361.42

    Type:
    Unknown

    AlogP:
    2.87

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  12. ALA5082302

    Name:
    N-(4-fluorobenzyl)-3'-oxo-5',6',8',8a'-tetrahydros
    Show More

    Mol. Formula:
    C26H22FN3O3

    M.W.:
    443.48

    Type:
    Unknown

    AlogP:
    4.10

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  13. ALA5082297

    Name:
    N-benzyl-3-oxo-1,1-diphenyltetrahydro-1H-oxazolo[3
    Show More

    Mol. Formula:
    C26H25N3O2S

    M.W.:
    443.57

    Type:
    Unknown

    AlogP:
    4.14

    Polar Surface Area:
    44.81

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  14. ALA5080648

    Name:
    (5S,8aR)-5-benzyl-N-(4-fluorobenzyl)-3-oxo-1,1-dip
    Show More

    Mol. Formula:
    C33H30FN3O3

    M.W.:
    535.62

    Type:
    Unknown

    AlogP:
    5.73

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  15. ALA5077999

    Name:
    (5S,8aR)-N-(4-fluorobenzyl)-5-methyl-3-oxo-1,1-dip
    Show More

    Mol. Formula:
    C27H26FN3O3

    M.W.:
    459.52

    Type:
    Unknown

    AlogP:
    4.50

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  16. ALA5077621

    Name:
    (5S,8aR)-N-(4-fluorobenzyl)-3-oxo-1,1,5-triphenylt
    Show More

    Mol. Formula:
    C32H28FN3O3

    M.W.:
    521.59

    Type:
    Unknown

    AlogP:
    5.86

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  17. ALA5076166

    Name:
    N-benzyl-3-oxo-1,1-diphenyltetrahydro-1H-oxazolo[3
    Show More

    Mol. Formula:
    C26H26N4O2

    M.W.:
    426.52

    Type:
    Unknown

    AlogP:
    3.79

    Polar Surface Area:
    68.66

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  18. ALA5075453

    Name:
    N-(4-fluorobenzyl)-1,1-bis(4-fluorophenyl)-3-oxote
    Show More

    Mol. Formula:
    C26H22F3N3O3

    M.W.:
    481.47

    Type:
    Unknown

    AlogP:
    4.39

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  19. ALA5071656

    Name:
    N-(4-fluorobenzyl)-3-oxo-1,1-dipropyltetrahydro-1H
    Show More

    Mol. Formula:
    C20H28FN3O3

    M.W.:
    377.46

    Type:
    Unknown

    AlogP:
    3.51

    Polar Surface Area:
    61.88

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  20. ALA1765705

    Name:
    SFRNGVGSGAKKTSFRRAKQ

    Mol. Formula:
    C93H156N34O27

    M.W.:
    2182.48

    Type:
    Protein

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
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