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  1. ALA4787722

    Name:
    (Z)-N-(2-(Diethylamino)ethyl)-2,4-dimethyl-5-((6-methyl-2-oxoindolin-3-ylidShow More

    Mol. Formula:
    C23H30N4O2

    M.W.:
    394.52

    Type:
    Unknown

    AlogP:
    3.50

    Polar Surface Area:
    77.23

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  2. ALA4777514

    Name:
    (Z)-N-(2-(Diethylamino)ethyl)-5-((6-isopropyl-2-oxoindolin-3-ylidene)methylShow More

    Mol. Formula:
    C25H34N4O2

    M.W.:
    422.57

    Type:
    Unknown

    AlogP:
    4.32

    Polar Surface Area:
    77.23

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  3. ALA3969654

    Name:
    US9428501, 58

    Mol. Formula:
    C32H36F3N7O2

    M.W.:
    607.68

    Type:
    Small molecule

    AlogP:
    5.04

    Polar Surface Area:
    79.62

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  4. ALA3941150

    Name:
    US9428501, 50

    Mol. Formula:
    C31H34F3N7O2

    M.W.:
    593.65

    Type:
    Small molecule

    AlogP:
    4.49

    Polar Surface Area:
    79.10

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  5. ALA3895466

    Name:
    US9428501, 19

    Mol. Formula:
    C33H37F3N6O2

    M.W.:
    606.69

    Type:
    Small molecule

    AlogP:
    5.33

    Polar Surface Area:
    66.73

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  6. ALA3892677

    Name:
    US9428501, 14

    Mol. Formula:
    C33H36F3N5O2

    M.W.:
    591.68

    Type:
    Small molecule

    AlogP:
    5.93

    Polar Surface Area:
    64.70

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  7. ALA3430788

    Name:
    K00612a

    Mol. Formula:

    M.W.:

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  8. ALA3430787

    Name:
    K00596a

    Mol. Formula:

    M.W.:

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  9. ALA3430786

    Name:
    K00565a

    Mol. Formula:

    M.W.:

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  10. ALA3430785

    Name:
    K00564a

    Mol. Formula:
    C18H15N3O3S

    M.W.:
    353.40

    Type:
    Small molecule

    AlogP:
    2.32

    Polar Surface Area:
    94.19

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  11. ALA3430784

    Name:
    K00081

    Mol. Formula:
    C20H15ClF3N3O2

    M.W.:
    421.81

    Type:
    Small molecule

    AlogP:
    5.65

    Polar Surface Area:
    63.25

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  12. ALA3430783

    Name:
    K00069

    Mol. Formula:

    M.W.:

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  13. ALA3430782

    Name:
    K00238

    Mol. Formula:

    M.W.:

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  14. Bisindolylmaleimide VIII acetate

    Name:
    K00202

    Mol. Formula:
    C26H26N4O4

    M.W.:
    458.52

    Type:
    Small molecule

    AlogP:
    3.05

    Polar Surface Area:
    82.05

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  15. ALA2398111

    Name:
    2-chloro-5-((Z)-((E)-5-((5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl)-methylenShow More

    Mol. Formula:
    C23H16ClN3O6S

    M.W.:
    497.92

    Type:
    Small molecule

    AlogP:
    5.71

    Polar Surface Area:
    135.04

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  16. ALA558969

    Name:
    K00592a

    Mol. Formula:
    C14H16ClF3N6O

    M.W.:
    376.77

    Type:
    Small molecule

    AlogP:
    1.71

    Polar Surface Area:
    118.95

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  17. ALA408678

    Name:
    K00567a

    Mol. Formula:
    C20H13ClFN3O

    M.W.:
    365.80

    Type:
    Small molecule

    AlogP:
    4.69

    Polar Surface Area:
    50.68

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  18. ALA411645

    Name:
    K00192

    Mol. Formula:
    C16H10IN3O2

    M.W.:
    403.18

    Type:
    Small molecule

    AlogP:
    3.26

    Polar Surface Area:
    73.72

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  19. ALA7064

    Name:
    K00068

    Mol. Formula:
    C14H8N2O

    M.W.:
    220.23

    Type:
    Small molecule

    AlogP:
    2.77

    Polar Surface Area:
    45.75

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.49

    DETAILS
  20. ALA126254

    Name:
    K00014

    Mol. Formula:
    C19H25ClN6O

    M.W.:
    388.90

    Type:
    Small molecule

    AlogP:
    4.01

    Polar Surface Area:
    79.10

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
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