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  1. ALA5196942

    Name:
    3-amino-5-(2-(dimethylamino)ethyl)-8,9-dimethoxydi
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    Mol. Formula:
    C22H24N4O3

    M.W.:
    392.46

    Type:
    ---

    AlogP:
    2.86

    Polar Surface Area:
    82.61

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  2. ALA5194864

    Name:
    2,3-dimethoxy-[1,3]dioxolo[4',5':4,5]benzo[1,2-i]p
    Show More

    Mol. Formula:
    C20H15NO4

    M.W.:
    333.34

    Type:
    ---

    AlogP:
    4.29

    Polar Surface Area:
    49.81

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  3. ALA5186082

    Name:
    2-methoxy-[1,3]dioxolo[4,5-g]naphtho[1,2-c]cinnoli
    Show More

    Mol. Formula:
    C18H12N2O3

    M.W.:
    304.31

    Type:
    ---

    AlogP:
    3.67

    Polar Surface Area:
    53.47

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  4. ALA5178685

    Name:
    2-amino-5-(2-(dimethylamino)ethyl)-8,9-dimethoxydi
    Show More

    Mol. Formula:
    C22H24N4O3

    M.W.:
    392.46

    Type:
    ---

    AlogP:
    2.86

    Polar Surface Area:
    82.61

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  5. ALA363340

    Name:
    12-(2-Ethylamino-ethyl)-2,3-dimethoxy-12H-8,10-dio
    Show More

    Mol. Formula:
    C23H23N3O5

    M.W.:
    421.45

    Type:
    Small molecule

    AlogP:
    3.06

    Polar Surface Area:
    83.84

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  6. ALA195377

    Name:
    12-(2-Butylamino-ethyl)-2,3-dimethoxy-12H-8,10-dio
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    Mol. Formula:
    C25H27N3O5

    M.W.:
    449.51

    Type:
    Small molecule

    AlogP:
    3.84

    Polar Surface Area:
    83.84

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  7. ALA191909

    Name:
    2,3-Dimethoxy-12-[2-(4-methyl-piperidin-1-yl)-ethy
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    Mol. Formula:
    C27H29N3O5

    M.W.:
    475.55

    Type:
    Small molecule

    AlogP:
    4.18

    Polar Surface Area:
    75.05

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  8. ALA540712

    Name:
    12-[2-(Ethyl-propyl-amino)-ethyl]-2,3-dimethoxy-12
    Show More

    Mol. Formula:
    C26H29N3O5

    M.W.:
    463.53

    Type:
    Small molecule

    AlogP:
    4.18

    Polar Surface Area:
    75.05

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  9. Type:
    Small molecule

    AlogP:
    2.67

    Polar Surface Area:
    83.84

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  10. ALA192202

    Name:
    12-[2-(Benzyl-propyl-amino)-ethyl]-2,3-dimethoxy-1
    Show More

    Mol. Formula:
    C31H31N3O5

    M.W.:
    525.61

    Type:
    Small molecule

    AlogP:
    5.36

    Polar Surface Area:
    75.05

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  11. ALA195107

    Name:
    2,3-Dimethoxy-12-(2-propylamino-ethyl)-12H-8,10-di
    Show More

    Mol. Formula:
    C24H25N3O5

    M.W.:
    435.48

    Type:
    Small molecule

    AlogP:
    3.45

    Polar Surface Area:
    83.84

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  12. ALA195792

    Name:
    2,3-Dimethoxy-12-(2-piperazin-1-yl-ethyl)-12H-8,10
    Show More

    Mol. Formula:
    C25H26N4O5

    M.W.:
    462.51

    Type:
    Small molecule

    AlogP:
    2.35

    Polar Surface Area:
    87.08

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  13. ALA194932

    Name:
    12-[2-(4-Benzyl-piperazin-1-yl)-ethyl]-2,3-dimetho
    Show More

    Mol. Formula:
    C32H32N4O5

    M.W.:
    552.63

    Type:
    Small molecule

    AlogP:
    4.27

    Polar Surface Area:
    78.29

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  14. ALA195611

    Name:
    12-[2-(Benzyl-butyl-amino)-ethyl]-2,3-dimethoxy-12
    Show More

    Mol. Formula:
    C32H33N3O5

    M.W.:
    539.63

    Type:
    Small molecule

    AlogP:
    5.75

    Polar Surface Area:
    75.05

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  15. ALA363839

    Name:
    2,3-Dimethoxy-12-(2-pyrrolidin-1-yl-ethyl)-12H-8,1
    Show More

    Mol. Formula:
    C25H25N3O5

    M.W.:
    447.49

    Type:
    Small molecule

    AlogP:
    3.54

    Polar Surface Area:
    75.05

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  16. ALA370251

    Name:
    12-[2-(Benzyl-methyl-amino)-ethyl]-2,3-dimethoxy-1
    Show More

    Mol. Formula:
    C29H27N3O5

    M.W.:
    497.55

    Type:
    Small molecule

    AlogP:
    4.58

    Polar Surface Area:
    75.05

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  17. ALA195805

    Name:
    12-(2-Amino-ethyl)-2,3-dimethoxy-12H-8,10-dioxa-6,
    Show More

    Mol. Formula:
    C21H19N3O5

    M.W.:
    393.40

    Type:
    Small molecule

    AlogP:
    2.41

    Polar Surface Area:
    97.83

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  18. ALA195102

    Name:
    2,3-Dimethoxy-12-[2-(4-methyl-piperazin-1-yl)-ethy
    Show More

    Mol. Formula:
    C26H28N4O5

    M.W.:
    476.53

    Type:
    Small molecule

    AlogP:
    2.70

    Polar Surface Area:
    78.29

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  19. ALA195148

    Name:
    12-[2-(Benzyl-phenethyl-amino)-ethyl]-2,3-dimethox
    Show More

    Mol. Formula:
    C35H31N3O5

    M.W.:
    573.65

    Type:
    Small molecule

    AlogP:
    6.15

    Polar Surface Area:
    75.05

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  20. ALA191245

    Name:
    12-(2-Dipropylamino-ethyl)-2,3-dimethoxy-12H-8,10-
    Show More

    Mol. Formula:
    C27H31N3O5

    M.W.:
    477.56

    Type:
    Small molecule

    AlogP:
    4.57

    Polar Surface Area:
    75.05

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
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