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  1. ALA5272055

    Name:
    N1-(1,2,3,4-tetrahydroacridin-9-yl)-N10-(((3aR,5R,5aS,8aS,8bR)-2,2,7,7-tetrShow More

    Mol. Formula:
    C35H53N3O5

    M.W.:
    595.83

    Type:
    ---

    AlogP:
    6.63

    Polar Surface Area:
    83.10

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  2. ALA5282048

    Name:
    (3aR,5S,6R,6aR)-2,2-dimethyl-5-((7-((1,2,3,4-tetrahydroacridin-9-yl)amino)hShow More

    Mol. Formula:
    C27H39N3O4

    M.W.:
    469.63

    Type:
    ---

    AlogP:
    4.26

    Polar Surface Area:
    84.87

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  3. ALA5280820

    Name:
    1-ethyl-3-(6-(5-((prop-2-yn-1-ylamino)methyl)-1H-benzo[d]imidazol-1-yl)pyriShow More

    Mol. Formula:
    C18H19N7S

    M.W.:
    365.47

    Type:
    ---

    AlogP:
    1.84

    Polar Surface Area:
    79.69

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  4. ALA5285687

    Name:
    N1-(((3aR,4R,6R,6aR)-6-methoxy-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxolShow More

    Mol. Formula:
    C32H49N3O4

    M.W.:
    539.76

    Type:
    ---

    AlogP:
    6.13

    Polar Surface Area:
    73.87

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  5. ALA5288285

    Name:
    (3aR,5R,6S,6aR)-2,2-dimethyl-5-(((11-((1,2,3,4-tetrahydroacridin-9-yl)aminoShow More

    Mol. Formula:
    C32H49N3O4

    M.W.:
    539.76

    Type:
    ---

    AlogP:
    5.86

    Polar Surface Area:
    84.87

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  6. ALA5209880

    Name:
    (E)-1-benzyl-4(2-((3,4-dimethoxyphenyl)sulfonyl)vinyl)piperidine

    Mol. Formula:
    C22H27NO4S

    M.W.:
    401.53

    Type:
    ---

    AlogP:
    3.90

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  7. ALA5208030

    Name:
    (Z)-1-benzyl-4(2-chloro-2-((3,4-dimethoxyphenyl)sulfonyl)vinyl)piperidine

    Mol. Formula:
    C22H26ClNO4S

    M.W.:
    435.97

    Type:
    ---

    AlogP:
    4.47

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  8. ALA5206971

    Name:
    2-((4-Fluoro-1-(2-chlorobenzyl)piperidin-4-yl)methyl)-5,6-dimethoxy-2,3-dihShow More

    Mol. Formula:
    C23H27ClFNO4S

    M.W.:
    467.99

    Type:
    ---

    AlogP:
    4.45

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  9. ALA5205085

    Name:
    2-((1-(3-Chloro-4-fluorobenzyl)-4-fluoropiperidin-4-yl)methyl)-5,6-dimethoxShow More

    Mol. Formula:
    C23H26ClF2NO4S

    M.W.:
    485.98

    Type:
    ---

    AlogP:
    4.59

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  10. ALA5204649

    Name:
    2-((1-Benzyl-4-fluoropiperidin-4-yl)methyl)-5,6-dimethoxy-2,3-dihydrobenzo[Show More

    Mol. Formula:
    C23H28FNO4S

    M.W.:
    433.55

    Type:
    ---

    AlogP:
    3.80

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  11. ALA5204001

    Name:
    2-((1-(2,4-difluorobenzyl)-4-fluoropiperidin-4-yl)methyl)-5,6-dimethoxy-2,3Show More

    Mol. Formula:
    C23H26F3NO4S

    M.W.:
    469.53

    Type:
    ---

    AlogP:
    4.07

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  12. ALA5202413

    Name:
    2-((1-benzylpiperidin-4-yl)methyl)-5,6-dimethoxy-2,3-dihydrobenzo[b]thiopheShow More

    Mol. Formula:
    C23H29NO4S

    M.W.:
    415.56

    Type:
    ---

    AlogP:
    3.70

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  13. ALA5201084

    Name:
    2-((4-Fluoro-1-(4-fluorobenzyl)piperidin-4-yl)methyl)-5,6-dimethoxy-2,3-dihShow More

    Mol. Formula:
    C23H27F2NO4S

    M.W.:
    451.54

    Type:
    ---

    AlogP:
    3.94

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  14. ALA5200196

    Name:
    (E)-2-((1-benzylpiperidin-4-yl)methylene)-5,6-dimethoxy-2,3-dihydrobenzo[b]Show More

    Mol. Formula:
    C23H27NO4S

    M.W.:
    413.54

    Type:
    ---

    AlogP:
    3.83

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  15. ALA5199752

    Name:
    2-((4-Fluoro-1-(2-fluorobenzyl)piperidin-4-yl)methyl)-5,6-dimethoxy-2,3-dihShow More

    Mol. Formula:
    C23H27F2NO4S

    M.W.:
    451.54

    Type:
    ---

    AlogP:
    3.94

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  16. ALA5199093

    Name:
    (E)-2-((1-benzylpiperidin-4-yl)methylene)-7,8-dimethoxy-2,3,4,5-tetrahydrobShow More

    Mol. Formula:
    C25H31NO4S

    M.W.:
    441.59

    Type:
    ---

    AlogP:
    4.61

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  17. ALA5198028

    Name:
    2-((4-Fluoro-1-(3-methylbenzyl)piperidin-4-yl)methyl)-5,6-dimethoxy-2,3-dihShow More

    Mol. Formula:
    C24H30FNO4S

    M.W.:
    447.57

    Type:
    ---

    AlogP:
    4.11

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  18. ALA5197334

    Name:
    (E)-2-((1-benzylpiperidin-4-yl)methylene)-6,7-dimethoxythiochromane 1,1-dioShow More

    Mol. Formula:
    C24H29NO4S

    M.W.:
    427.57

    Type:
    ---

    AlogP:
    4.22

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  19. ALA5193449

    Name:
    2-((4-Fluoro-1-(2-(trifluoromethyl)benzyl)piperidin-4-yl)methyl)-5,6-dimethShow More

    Mol. Formula:
    C24H27F4NO4S

    M.W.:
    501.54

    Type:
    ---

    AlogP:
    4.82

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  20. ALA5190674

    Name:
    2-((1-(3-Fluorobenzyl)piperidin-4-yl)methyl)-5,6-dimethoxy-2,3-dihydrobenzoShow More

    Mol. Formula:
    C23H28FNO4S

    M.W.:
    433.55

    Type:
    ---

    AlogP:
    3.84

    Polar Surface Area:
    55.84

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
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