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  1. ALA4445751

    Name:
    (4-(4-fluorophenyl)benzo[b]thiophen-2-yl)(morpholino)methanone

    Mol. Formula:
    C19H16FNO2S

    M.W.:
    341.41

    Type:
    Unknown

    AlogP:
    4.18

    Polar Surface Area:
    29.54

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  2. ALA4105556

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-(4-methylpiperazin-1-yl)pyrimiShow More

    Mol. Formula:
    C23H29N9O

    M.W.:
    447.55

    Type:
    Small molecule

    AlogP:
    3.10

    Polar Surface Area:
    114.10

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  3. ALA4102896

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-morpholino-1,3,5-triazin-2-yl)Show More

    Mol. Formula:
    C24H31N9O2

    M.W.:
    477.57

    Type:
    Small molecule

    AlogP:
    3.75

    Polar Surface Area:
    132.98

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  4. ALA4102418

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-(piperidin-1-yl)-1,3,5-triazinShow More

    Mol. Formula:
    C25H32N8OS

    M.W.:
    492.65

    Type:
    Small molecule

    AlogP:
    5.31

    Polar Surface Area:
    111.72

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  5. ALA4102307

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-(4-methylpiperazin-1-yl)pyrimiShow More

    Mol. Formula:
    C26H35N9O

    M.W.:
    489.63

    Type:
    Small molecule

    AlogP:
    4.27

    Polar Surface Area:
    114.10

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  6. ALA4099814

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-morpholinopyrimidin-2-yl)aminoShow More

    Mol. Formula:
    C25H32N8O2

    M.W.:
    476.59

    Type:
    Small molecule

    AlogP:
    4.35

    Polar Surface Area:
    120.09

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  7. ALA4098445

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-(4-methylpiperazin-1-yl)pyrimiShow More

    Mol. Formula:
    C26H34N8OS

    M.W.:
    506.68

    Type:
    Small molecule

    AlogP:
    4.67

    Polar Surface Area:
    102.07

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  8. ALA4098058

    Name:
    N-(4-((4-((4,5-Dimethyl-1H-pyrazol-3-yl)amino)-6-morpholino-1,3,5-triazin-2Show More

    Mol. Formula:
    C25H32N8O2S

    M.W.:
    508.65

    Type:
    Small molecule

    AlogP:
    4.46

    Polar Surface Area:
    120.95

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  9. ALA4097396

    Name:
    N-(4-((4-((4,5-Dimethyl-1H-pyrazol-3-yl)amino)-6-morpholinopyrimidin-2-yl)aShow More

    Mol. Formula:
    C26H34N8O2

    M.W.:
    490.61

    Type:
    Small molecule

    AlogP:
    4.66

    Polar Surface Area:
    120.09

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  10. ALA4095144

    Name:
    N-(4-((4-((4,5-Dimethyl-1H-pyrazol-3-yl)amino)-6-(4-methylpiperazin-1-yl)-1Show More

    Mol. Formula:
    C23H30N10O

    M.W.:
    462.56

    Type:
    Small molecule

    AlogP:
    2.80

    Polar Surface Area:
    126.99

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  11. ALA4094672

    Name:
    N-(4-((4-((4,5-Dimethyl-1H-pyrazol-3-yl)amino)-6-morpholino-1,3,5-triazin-2Show More

    Mol. Formula:
    C22H26N8O2S

    M.W.:
    466.57

    Type:
    Small molecule

    AlogP:
    3.29

    Polar Surface Area:
    120.95

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  12. ALA4092699

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-(piperidin-1-yl)-1,3,5-triazinShow More

    Mol. Formula:
    C22H27N9O

    M.W.:
    433.52

    Type:
    Small molecule

    AlogP:
    3.73

    Polar Surface Area:
    123.75

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  13. ALA4092326

    Name:
    N-(4-((4-((4,5-Dimethyl-1H-pyrazol-3-yl)amino)-6-morpholino-1,3,5-triazin-2Show More

    Mol. Formula:
    C25H33N9O2

    M.W.:
    491.60

    Type:
    Small molecule

    AlogP:
    4.05

    Polar Surface Area:
    132.98

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  14. ALA4092214

    Name:
    N-(4-((4-((4,5-Dimethyl-1H-pyrazol-3-yl)amino)-6-(piperidin-1-yl)-1,3,5-triShow More

    Mol. Formula:
    C26H34N8OS

    M.W.:
    506.68

    Type:
    Small molecule

    AlogP:
    5.62

    Polar Surface Area:
    111.72

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  15. ALA4090723

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-morpholinopyrimidin-2-yl)aminoShow More

    Mol. Formula:
    C22H26N8O2

    M.W.:
    434.50

    Type:
    Small molecule

    AlogP:
    3.18

    Polar Surface Area:
    120.09

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  16. ALA4089676

    Name:
    N-(4-((4-((4,5-Dimethyl-1H-pyrazol-3-yl)amino)-6-morpholinopyrimidin-2-yl)aShow More

    Mol. Formula:
    C23H28N8O2

    M.W.:
    448.53

    Type:
    Small molecule

    AlogP:
    3.49

    Polar Surface Area:
    120.09

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  17. ALA4089624

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-(piperidin-1-yl)pyrimidin-2-ylShow More

    Mol. Formula:
    C23H27N7OS

    M.W.:
    449.58

    Type:
    Small molecule

    AlogP:
    4.74

    Polar Surface Area:
    98.83

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  18. ALA4086975

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-(4-methylpiperazin-1-yl)-1,3,5Show More

    Mol. Formula:
    C22H27N9OS

    M.W.:
    465.59

    Type:
    Small molecule

    AlogP:
    2.90

    Polar Surface Area:
    114.96

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  19. ALA4084466

    Name:
    N-(4-((4-((5-Methyl-1H-pyrazol-3-yl)amino)-6-morpholino-1,3,5-triazin-2-yl)Show More

    Mol. Formula:
    C24H30N8O2S

    M.W.:
    494.63

    Type:
    Small molecule

    AlogP:
    4.15

    Polar Surface Area:
    120.95

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  20. ALA4083590

    Name:
    N-(4-((4-((4,5-Dimethyl-1H-pyrazol-3-yl)amino)-6-(piperidin-1-yl)pyrimidin-Show More

    Mol. Formula:
    C27H36N8O

    M.W.:
    488.64

    Type:
    Small molecule

    AlogP:
    5.81

    Polar Surface Area:
    110.86

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
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