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  1. ALA5270892

    Name:
    Evodiamine

    Mol. Formula:
    C18H15N3O

    M.W.:
    289.34

    Type:
    ---

    AlogP:
    3.29

    Polar Surface Area:
    48.13

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  2. ALA5270585

    Name:
    14-(6-chloropyridin-3-yl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-Show More

    Mol. Formula:
    C23H17ClN4O

    M.W.:
    400.87

    Type:
    ---

    AlogP:
    5.07

    Polar Surface Area:
    52.23

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  3. ALA5281324

    Name:
    14-(quinoxalin-6-yl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quiShow More

    Mol. Formula:
    C26H19N5O

    M.W.:
    417.47

    Type:
    ---

    AlogP:
    4.96

    Polar Surface Area:
    65.12

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  4. ALA5279850

    Name:
    14-(6-methylpyridin-3-yl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-Show More

    Mol. Formula:
    C24H20N4O

    M.W.:
    380.45

    Type:
    ---

    AlogP:
    4.72

    Polar Surface Area:
    52.23

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  5. ALA5278401

    Name:
    14-(2-chlorophenyl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinShow More

    Mol. Formula:
    C24H18ClN3O

    M.W.:
    399.88

    Type:
    ---

    AlogP:
    5.67

    Polar Surface Area:
    39.34

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  6. ALA5273905

    Name:
    14-(4-chlorophenyl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinShow More

    Mol. Formula:
    C24H18ClN3O

    M.W.:
    399.88

    Type:
    ---

    AlogP:
    5.67

    Polar Surface Area:
    39.34

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  7. ALA5273886

    Name:
    14-(p-tolyl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-Show More

    Mol. Formula:
    C25H21N3O

    M.W.:
    379.46

    Type:
    ---

    AlogP:
    5.33

    Polar Surface Area:
    39.34

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  8. ALA5286877

    Name:
    14-(pyridin-3-yl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazShow More

    Mol. Formula:
    C23H18N4O

    M.W.:
    366.42

    Type:
    ---

    AlogP:
    4.41

    Polar Surface Area:
    52.23

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  9. ALA5283736

    Name:
    14-(4-methoxyphenyl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quiShow More

    Mol. Formula:
    C25H21N3O2

    M.W.:
    395.46

    Type:
    ---

    AlogP:
    5.03

    Polar Surface Area:
    48.57

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  10. ALA5291173

    Name:
    14-(2-bromophenyl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinaShow More

    Mol. Formula:
    C24H18BrN3O

    M.W.:
    444.33

    Type:
    ---

    AlogP:
    5.78

    Polar Surface Area:
    39.34

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  11. ALA5290442

    Name:
    14-(4-bromophenyl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinaShow More

    Mol. Formula:
    C24H18BrN3O

    M.W.:
    444.33

    Type:
    ---

    AlogP:
    5.78

    Polar Surface Area:
    39.34

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  12. ALA5289802

    Name:
    14-(o-tolyl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-Show More

    Mol. Formula:
    C25H21N3O

    M.W.:
    379.46

    Type:
    ---

    AlogP:
    5.33

    Polar Surface Area:
    39.34

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  13. ALA5277629

    Name:
    14-(5-bromopyridin-3-yl)-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-bShow More

    Mol. Formula:
    C23H17BrN4O

    M.W.:
    445.32

    Type:
    ---

    AlogP:
    5.17

    Polar Surface Area:
    52.23

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  14. ALA5208249

    Name:
    pyridin-3-ylmethyl 4-(3-methyl-2-(pyrrolidin-1-yl)benzamido)benzylcarbamate

    Mol. Formula:
    C26H28N4O3

    M.W.:
    444.54

    Type:
    ---

    AlogP:
    4.67

    Polar Surface Area:
    83.56

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  15. ALA5208000

    Name:
    pyridin-3-ylmethyl 4-(5-fluoro-2-(pyrrolidin-1-yl)benzamido)benzylcarbamate

    Mol. Formula:
    C25H25FN4O3

    M.W.:
    448.50

    Type:
    ---

    AlogP:
    4.50

    Polar Surface Area:
    83.56

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  16. ALA5207772

    Name:
    pyridin-3-ylmethyl 4-(3-fluoro-2-(pyrrolidin-1-yl)benzamido)benzylcarbamate

    Mol. Formula:
    C25H25FN4O3

    M.W.:
    448.50

    Type:
    ---

    AlogP:
    4.50

    Polar Surface Area:
    83.56

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  17. ALA5198405

    Name:
    pyridin-3-ylmethyl 4-(5-chloro-2-(pyrrolidin-1-yl)benzamido)benzylcarbamate

    Mol. Formula:
    C25H25ClN4O3

    M.W.:
    464.95

    Type:
    ---

    AlogP:
    5.01

    Polar Surface Area:
    83.56

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  18. ALA5193979

    Name:
    pyridin-3-ylmethyl 4-(5-methoxy-2-(pyrrolidin-1-yl)benzamido)benzylcarbamatShow More

    Mol. Formula:
    C26H28N4O4

    M.W.:
    460.53

    Type:
    ---

    AlogP:
    4.37

    Polar Surface Area:
    92.79

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  19. ALA5189245

    Name:
    pyridin-3-ylmethyl 4-(4-fluoro-2-(pyrrolidin-1-yl)benzamido)benzylcarbamate

    Mol. Formula:
    C25H25FN4O3

    M.W.:
    448.50

    Type:
    ---

    AlogP:
    4.50

    Polar Surface Area:
    83.56

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  20. ALA5180127

    Name:
    pyridin-3-ylmethyl 4-(5-bromo-2-(pyrrolidin-1-yl)benzamido)benzylcarbamate

    Mol. Formula:
    C25H25BrN4O3

    M.W.:
    509.40

    Type:
    ---

    AlogP:
    5.12

    Polar Surface Area:
    83.56

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
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