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  1. ALA4878570

    Name:
    1-(3-(1,3-di(9H-carbazol-9-yl)propan-2-yloxy)-2-hy
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    Mol. Formula:
    C36H38N4O4

    M.W.:
    590.72

    Type:
    Unknown

    AlogP:
    5.57

    Polar Surface Area:
    91.89

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  2. ALA4547807

    Name:
    N-(1-Benzylpiperidin-4-yl)-7-benzyloxy-2-(4-phenyl
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    Mol. Formula:
    C37H40N6O

    M.W.:
    584.77

    Type:
    Unknown

    AlogP:
    6.61

    Polar Surface Area:
    56.76

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  3. ALA5207209

    Name:
    (2S)-2-amino-4-[[4-amino-1-[(2R,4S,5R)-4-hydroxy-5
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    Mol. Formula:
    C14H23N5O6

    M.W.:
    357.37

    Type:
    ---

    AlogP:
    -2.64

    Polar Surface Area:
    185.95

    HBA:
    10

    HBD:
    6

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  4. ALA5200086

    Name:
    4-amino-5-[3-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)
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    Mol. Formula:
    C22H31N9O7

    M.W.:
    533.55

    Type:
    ---

    AlogP:
    -2.97

    Polar Surface Area:
    241.94

    HBA:
    16

    HBD:
    7

    #RO5 Violations:
    3

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  5. ALA5193031

    Name:
    (2S)-2-amino-4-[3-[4-amino-1-[(2R,4S,5R)-4-hydroxy
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    Mol. Formula:
    C26H38N10O9

    M.W.:
    634.65

    Type:
    ---

    AlogP:
    -3.46

    Polar Surface Area:
    296.47

    HBA:
    18

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  6. ALA5192832

    Name:
    (2S)-2-amino-4-[[4-amino-1-[(2R,4S,5R)-4-hydroxy-5
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    Mol. Formula:
    C24H34N10O9

    M.W.:
    606.60

    Type:
    ---

    AlogP:
    -3.89

    Polar Surface Area:
    296.47

    HBA:
    18

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  7. ALA5191050

    Name:
    (2S)-2-amino-5-[[[4-amino-1-[(2R,4S,5R)-4-hydroxy-
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    Mol. Formula:
    C26H38N10O9

    M.W.:
    634.65

    Type:
    ---

    AlogP:
    -3.20

    Polar Surface Area:
    305.26

    HBA:
    18

    HBD:
    9

    #RO5 Violations:
    3

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  8. ALA5189315

    Name:
    4-amino-5-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,
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    Mol. Formula:
    C20H26N8O7S

    M.W.:
    522.54

    Type:
    ---

    AlogP:
    -2.26

    Polar Surface Area:
    229.91

    HBA:
    16

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  9. ALA5189142

    Name:
    4-amino-5-[3-[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-
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    Mol. Formula:
    C22H30N8O7S

    M.W.:
    550.60

    Type:
    ---

    AlogP:
    -1.48

    Polar Surface Area:
    229.91

    HBA:
    16

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  10. ALA5188584

    Name:
    (2S)-2-amino-4-[5-[6-amino-3-[(2R,4S,5R)-4-hydroxy
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    Mol. Formula:
    C27H43N11O9

    M.W.:
    665.71

    Type:
    ---

    AlogP:
    -3.22

    Polar Surface Area:
    297.49

    HBA:
    17

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  11. ALA5188258

    Name:
    (2S)-2-amino-6-[[4-amino-1-[(2R,4S,5R)-4-hydroxy-5
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    Mol. Formula:
    C16H27N5O6

    M.W.:
    385.42

    Type:
    ---

    AlogP:
    -1.86

    Polar Surface Area:
    185.95

    HBA:
    10

    HBD:
    6

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  12. ALA5187655

    Name:
    4-amino-5-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3
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    Mol. Formula:
    C20H27N9O7

    M.W.:
    505.49

    Type:
    ---

    AlogP:
    -3.40

    Polar Surface Area:
    241.94

    HBA:
    16

    HBD:
    7

    #RO5 Violations:
    3

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  13. ALA5187336

    Name:
    (2S)-2-amino-4-[2-[4-amino-1-[(2R,4S,5R)-4-hydroxy
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    Mol. Formula:
    C25H36N10O9S

    M.W.:
    652.69

    Type:
    ---

    AlogP:
    -3.30

    Polar Surface Area:
    296.47

    HBA:
    19

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
  14. ALA5178532

    Name:
    (2S)-2-amino-6-[[4-amino-1-[(2R,4S,5R)-4-hydroxy-5
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    Mol. Formula:
    C16H26N4O6S

    M.W.:
    402.47

    Type:
    ---

    AlogP:
    -0.72

    Polar Surface Area:
    173.92

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  15. ALA5174871

    Name:
    (2S)-2-amino-4-[2-[4-amino-1-[(2R,4S,5R)-4-hydroxy
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    Mol. Formula:
    C25H36N10O9

    M.W.:
    620.62

    Type:
    ---

    AlogP:
    -3.85

    Polar Surface Area:
    296.47

    HBA:
    18

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  16. ALA5173333

    Name:
    (2S)-2-amino-4-[[4-amino-1-[(2R,4S,5R)-4-hydroxy-5
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    Mol. Formula:
    C14H22N4O6S

    M.W.:
    374.42

    Type:
    ---

    AlogP:
    -1.50

    Polar Surface Area:
    173.92

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  17. ALA5172874

    Name:
    4-amino-5-[3-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)
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    Mol. Formula:
    C22H30N8O7S

    M.W.:
    550.60

    Type:
    ---

    AlogP:
    -1.83

    Polar Surface Area:
    229.91

    HBA:
    16

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  18. ALA5170757

    Name:
    4-amino-5-[2-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)
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    Mol. Formula:
    C21H28N8O7S

    M.W.:
    536.57

    Type:
    ---

    AlogP:
    -2.22

    Polar Surface Area:
    229.91

    HBA:
    16

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  19. ALA4558658

    Name:
    tert-butyl 4-((2-((4-fluorobenzyl)amino)-6,7-dimet
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    Mol. Formula:
    C27H34FN5O4

    M.W.:
    511.60

    Type:
    Unknown

    AlogP:
    5.21

    Polar Surface Area:
    97.84

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  20. ALA4537137

    Name:
    4-((1-benzylpiperidin-4-yl)amino)-6-methoxy-2-(4-p
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    Mol. Formula:
    C31H36N6O2

    M.W.:
    524.67

    Type:
    Unknown

    AlogP:
    4.75

    Polar Surface Area:
    76.99

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
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