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  1. ALA4475595

    Name:
    N-(((1S,2R,4S,5S)-5-((4-benzylpiperidin-1-yl)methy
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    Mol. Formula:
    C29H37N3O3

    M.W.:
    475.63

    Type:
    Unknown

    AlogP:
    3.81

    Polar Surface Area:
    54.04

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  2. ALA4524391

    Name:
    (2R,3S,4R,5R)-2-(1,8-diazaspiro[4.5]decan-1-ylmeth
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    Mol. Formula:
    C19H29ClN6O3

    M.W.:
    424.93

    Type:
    Unknown

    AlogP:
    -0.15

    Polar Surface Area:
    121.69

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  3. ALA4554624

    Name:
    (1S,2S,3R,5S)-3-(4-amino-7H-pyrrolo[2,3-d]pyrimidi
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    Mol. Formula:
    C17H17ClN4O2S

    M.W.:
    376.87

    Type:
    Unknown

    AlogP:
    2.49

    Polar Surface Area:
    97.19

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  4. ALA4517481

    Name:
    (2R,3S,4R,5R)-2-((R)-hydroxy(1,2,3,4-tetrahydroiso
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    Mol. Formula:
    C21H24N4O4

    M.W.:
    396.45

    Type:
    Unknown

    AlogP:
    0.74

    Polar Surface Area:
    112.66

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  5. ALA4550297

    Name:
    (2S,5S)-2,5-diamino-6-((3S,4R,5R)-5-(6-amino-9H-pu
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    Mol. Formula:
    C15H21N7O5

    M.W.:
    379.38

    Type:
    Unknown

    AlogP:
    -1.94

    Polar Surface Area:
    208.65

    HBA:
    11

    HBD:
    6

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  6. ALA4547524

    Name:
    (1S,2S,3S,5R)-3-(6-(difluoromethyl)-1,2,3,4-tetrah
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    Mol. Formula:
    C22H24F2N4O3

    M.W.:
    430.46

    Type:
    Unknown

    AlogP:
    2.44

    Polar Surface Area:
    92.43

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  7. ALA4579108

    Name:
    (1S,2S,3R,5S)-3-(4-methyl-7H-pyrrolo[2,3-d]pyrimid
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    Mol. Formula:
    C22H23F3N4O3

    M.W.:
    448.45

    Type:
    Unknown

    AlogP:
    2.52

    Polar Surface Area:
    92.43

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  8. ALA4585734

    Name:
    (1S,2S,3R,5S)-3-(4-methyl-7H-pyrrolo[2,3-d]pyrimid
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    Mol. Formula:
    C21H24N4O3

    M.W.:
    380.45

    Type:
    Unknown

    AlogP:
    1.50

    Polar Surface Area:
    92.43

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  9. ALA4861625

    Name:
    (1S,2R,3aR,4S,6aR)-4-((2-amino-3,5-difluoroquinoli
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    Mol. Formula:
    C24H23F3N6O2

    M.W.:
    484.48

    Type:
    Unknown

    AlogP:
    2.87

    Polar Surface Area:
    136.10

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  10. ALA4860893

    Name:
    (2R,3R,3aS,6S,6aR)-6-((2-amino-3-fluoroquinolin-7-
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    Mol. Formula:
    C23H23FN6O3

    M.W.:
    450.47

    Type:
    Unknown

    AlogP:
    1.93

    Polar Surface Area:
    145.33

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  11. ALA4860414

    Name:
    (2R,3R,3aS,6S,6aR)-6-(2-amino-3-fluoroquinolin-7-y
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    Mol. Formula:
    C22H21FN6O4

    M.W.:
    452.45

    Type:
    Unknown

    AlogP:
    1.51

    Polar Surface Area:
    154.56

    HBA:
    10

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  12. ALA4878171

    Name:
    (2R,3R,3aS,6S,6aR)-6-((2-amino-3,5-difluoroquinoli
    Show More

    Mol. Formula:
    C23H22F2N6O3

    M.W.:
    468.46

    Type:
    Unknown

    AlogP:
    2.06

    Polar Surface Area:
    145.33

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  13. ALA4874774

    Name:
    (2R,3R,3aS,6S,6aR)-6-((2-amino-3-bromoquinolin-7-y
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    Mol. Formula:
    C24H24BrN5O3

    M.W.:
    510.39

    Type:
    Unknown

    AlogP:
    3.27

    Polar Surface Area:
    119.31

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  14. ALA4874354

    Name:
    (2R,3R,3aS,6S,6aR)-6-((2-amino-3-chloroquinolin-7-
    Show More

    Mol. Formula:
    C24H24ClN5O3

    M.W.:
    465.94

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    119.31

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  15. ALA4849342

    Name:
    (2R,3R,3aS,6S,6aR)-2-(4-amino-2-methyl-7H-pyrrolo[
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    Mol. Formula:
    C24H25BrN6O3

    M.W.:
    525.41

    Type:
    Unknown

    AlogP:
    2.86

    Polar Surface Area:
    145.33

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  16. ALA4849067

    Name:
    (2R,3R,3aS,6S,6aR)-6-((2-amino-3-bromoquinolin-7-y
    Show More

    Mol. Formula:
    C26H26BrN5O3

    M.W.:
    536.43

    Type:
    Unknown

    AlogP:
    3.84

    Polar Surface Area:
    119.31

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  17. ALA4848739

    Name:
    (2R,3R,3aS,6S,6aR)-6-((2-amino-3-fluoroquinolin-7-
    Show More

    Mol. Formula:
    C24H24FN5O3

    M.W.:
    449.49

    Type:
    Unknown

    AlogP:
    2.65

    Polar Surface Area:
    119.31

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  18. ALA4847518

    Name:
    (1S,2R,3aR,4S,6aR)-2-(4-amino-2-methyl-7H-pyrrolo[
    Show More

    Mol. Formula:
    C25H27FN6O2

    M.W.:
    462.53

    Type:
    Unknown

    AlogP:
    2.90

    Polar Surface Area:
    136.10

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  19. ALA4846860

    Name:
    (2R,3R,3aS,6S,6aR)-6-((2-amino-3-chloroquinolin-7-
    Show More

    Mol. Formula:
    C23H23ClN6O3

    M.W.:
    466.93

    Type:
    Unknown

    AlogP:
    2.44

    Polar Surface Area:
    145.33

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  20. ALA4846178

    Name:
    (1S,2R,3aR,4S,6aR)-4-((2-amino-3-bromoquinolin-7-y
    Show More

    Mol. Formula:
    C24H25BrN6O2

    M.W.:
    509.41

    Type:
    Unknown

    AlogP:
    3.21

    Polar Surface Area:
    136.10

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
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