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  1. ALA4856177

    Name:
    N-(4-(3-isopropyl-2-methyl-2H-indazol-5-yl)pyrimid
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    Mol. Formula:
    C29H32N8

    M.W.:
    492.63

    Type:
    Unknown

    AlogP:
    5.20

    Polar Surface Area:
    75.00

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  2. ALA4848734

    Name:
    3-Acetyl-7-((4-(3-isopropyl-2-methyl-2H-indazol-5-
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    Mol. Formula:
    C30H30N6O4

    M.W.:
    538.61

    Type:
    Unknown

    AlogP:
    5.04

    Polar Surface Area:
    115.38

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  3. ALA4546596

    Name:
    N-(naphthalen-2-yl)-2-[4-(4-oxo-3,4-dihydroquinazo
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    Mol. Formula:
    C26H19N3O3

    M.W.:
    421.46

    Type:
    Unknown

    AlogP:
    4.76

    Polar Surface Area:
    84.08

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  4. ALA4550841

    Name:
    (N-butyl-2-[2-methoxy-4-(4-oxo-3,4-dihydroquinazol
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    Mol. Formula:
    C21H23N3O4

    M.W.:
    381.43

    Type:
    Unknown

    AlogP:
    2.89

    Polar Surface Area:
    93.31

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  5. ALA4777302

    Name:
    (7-cyclopentyl-2-(5-(piperazin-1-yl)pyridin-2-ylam
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    Mol. Formula:
    C26H34N8O

    M.W.:
    474.61

    Type:
    Unknown

    AlogP:
    3.72

    Polar Surface Area:
    91.21

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  6. ALA5221074

    Name:
    6-acetyl-8-cyclopentyl-2-[2-methoxy-4-(4-methylpip
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    Mol. Formula:
    C25H31N7O3

    M.W.:
    477.57

    Type:
    ---

    AlogP:
    3.01

    Polar Surface Area:
    105.48

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  7. ALA5221054

    Name:
    8-cyclopentyl-6-(2-furyl)-2-(4-morpholinoanilino)p
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    Mol. Formula:
    C25H26N6O3

    M.W.:
    458.52

    Type:
    ---

    AlogP:
    4.14

    Polar Surface Area:
    98.31

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  8. ALA5221016

    Name:
    6-acetyl-8-cyclopentyl-2-[4-(4-ethylpiperazin-1-yl
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    Mol. Formula:
    C26H33N7O3

    M.W.:
    491.60

    Type:
    ---

    AlogP:
    2.88

    Polar Surface Area:
    116.48

    HBA:
    10

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  9. ALA5220828

    Name:
    6-acetyl-8-cyclopentyl-2-(4-morpholinoanilino)pter
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    Mol. Formula:
    C23H26N6O3

    M.W.:
    434.50

    Type:
    ---

    AlogP:
    3.08

    Polar Surface Area:
    102.24

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  10. ALA5220823

    Name:
    6-acetyl-8-cyclopentyl-2-[4-(4-ethylpiperazin-1-yl
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    Mol. Formula:
    C25H31N7O2

    M.W.:
    461.57

    Type:
    ---

    AlogP:
    3.39

    Polar Surface Area:
    96.25

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  11. ALA5220759

    Name:
    6-acetyl-8-cyclopentyl-2-[4-(1-piperidyl)anilino]p
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    Mol. Formula:
    C24H28N6O2

    M.W.:
    432.53

    Type:
    ---

    AlogP:
    4.24

    Polar Surface Area:
    93.01

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  12. ALA5220597

    Name:
    6-acetyl-8-cyclopentyl-2-[4-[4-(4-methylpiperazin-
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    Mol. Formula:
    C29H38N8O2

    M.W.:
    530.68

    Type:
    ---

    AlogP:
    3.46

    Polar Surface Area:
    99.49

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  13. ALA5220252

    Name:
    6-acetyl-8-cyclopentyl-2-(4-pyrrolidin-1-ylanilino
    Show More

    Mol. Formula:
    C23H26N6O2

    M.W.:
    418.50

    Type:
    ---

    AlogP:
    3.85

    Polar Surface Area:
    93.01

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  14. ALA5220201

    Name:
    6-acetyl-8-cyclopentyl-2-[4-(4-cyclopentylpiperazi
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    Mol. Formula:
    C28H35N7O2

    M.W.:
    501.64

    Type:
    ---

    AlogP:
    4.31

    Polar Surface Area:
    96.25

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  15. ALA5219478

    Name:
    8-cyclopentyl-2-[4-(4-ethylpiperazin-1-yl)anilino]
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    Mol. Formula:
    C27H31N7O2

    M.W.:
    485.59

    Type:
    ---

    AlogP:
    4.45

    Polar Surface Area:
    92.32

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  16. ALA5218932

    Name:
    6-acetyl-2-[2-amino-4-(4-ethylpiperazin-1-yl)anili
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    Mol. Formula:
    C25H32N8O2

    M.W.:
    476.59

    Type:
    ---

    AlogP:
    2.97

    Polar Surface Area:
    122.27

    HBA:
    10

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  17. ALA5218782

    Name:
    6-acetyl-8-cyclopentyl-2-[4-(4-methylpiperazin-1-y
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    Mol. Formula:
    C24H29N7O2

    M.W.:
    447.54

    Type:
    ---

    AlogP:
    3.00

    Polar Surface Area:
    96.25

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  18. ALA5208357

    Name:
    2-(2-chlorophenyl)-5,7-dihydroxy-8-((3R,4R)-4-hydr
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    Mol. Formula:
    C21H22ClNO5

    M.W.:
    403.86

    Type:
    ---

    AlogP:
    3.24

    Polar Surface Area:
    90.23

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  19. ALA5194888

    Name:
    2-(2-chlorophenyl)-5,7-dihydroxy-8-((3R,4S)-4-hydr
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    Mol. Formula:
    C21H22ClNO5

    M.W.:
    403.86

    Type:
    ---

    AlogP:
    3.24

    Polar Surface Area:
    90.23

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  20. ALA5193922

    Name:
    5,7-dihydroxy-8-((3R,4S)-3-hydroxy-1-methylpiperid
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    Mol. Formula:
    C21H23NO5

    M.W.:
    369.42

    Type:
    ---

    AlogP:
    2.58

    Polar Surface Area:
    90.23

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
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