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  1. ALA5265833

    Name:
    (1-(oct-7-yn-1-yl)piperidin-4-yl)methyl (3'-chloro-4',5-difluoro-[1,1'-biphShow More

    Mol. Formula:
    C27H31ClF2N2O2

    M.W.:
    489.01

    Type:
    ---

    AlogP:
    7.13

    Polar Surface Area:
    41.57

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  2. ALA5282659

    Name:
    1-(6-aminohexyl)piperidin-4-yl (3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yShow More

    Mol. Formula:
    C24H30ClF2N3O2

    M.W.:
    465.97

    Type:
    ---

    AlogP:
    5.82

    Polar Surface Area:
    67.59

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  3. ALA5281043

    Name:
    (1-(6-aminohexyl)piperidin-4-yl)methyl (3'-chloro-4',5-difluoro-[1,1'-bipheShow More

    Mol. Formula:
    C25H32ClF2N3O2

    M.W.:
    480.00

    Type:
    ---

    AlogP:
    6.06

    Polar Surface Area:
    67.59

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  4. ALA5279174

    Name:
    (1-(hept-6-yn-1-yl)piperidin-4-yl)methyl (3'-chloro-4',5-difluoro-[1,1'-bipShow More

    Mol. Formula:
    C26H29ClF2N2O2

    M.W.:
    474.98

    Type:
    ---

    AlogP:
    6.74

    Polar Surface Area:
    41.57

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  5. ALA5277670

    Name:
    1-(6-((6-(4-(((3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yl)carbamoyl)oxy)pShow More

    Mol. Formula:
    C56H67ClF2N5O3+

    M.W.:
    931.63

    Type:
    ---

    AlogP:
    13.04

    Polar Surface Area:
    76.92

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    19

    Passes Ro3:
    N

    QED Weighted:
    0.06

    DETAILS
  6. ALA5274545

    Name:
    3-(8-((3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-2,2-dimethylpropyl)diShow More

    Mol. Formula:
    C38H54Br2N4O4

    M.W.:
    790.68

    Type:
    ---

    AlogP:
    5.95

    Polar Surface Area:
    72.49

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.06

    DETAILS
  7. ALA5274390

    Name:
    piperidin-4-yl (3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yl)carbamate

    Mol. Formula:
    C18H17ClF2N2O2

    M.W.:
    366.80

    Type:
    ---

    AlogP:
    4.59

    Polar Surface Area:
    50.36

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  8. ALA5273907

    Name:
    1-(6-((6-(4-((((3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yl)carbamoyl)oxy)Show More

    Mol. Formula:
    C57H69ClF2N5O3+

    M.W.:
    945.66

    Type:
    ---

    AlogP:
    13.28

    Polar Surface Area:
    76.92

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    20

    Passes Ro3:
    N

    QED Weighted:
    0.05

    DETAILS
  9. ALA5272950

    Name:
    Desmethyl pilosinine

    Mol. Formula:
    C8H10N2O2

    M.W.:
    166.18

    Type:
    ---

    AlogP:
    0.52

    Polar Surface Area:
    54.98

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.65

    DETAILS
  10. ALA5289667

    Name:
    1-(6-((8-(4-(((3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yl)carbamoyl)oxy)pShow More

    Mol. Formula:
    C58H71ClF2N5O3+

    M.W.:
    959.69

    Type:
    ---

    AlogP:
    13.82

    Polar Surface Area:
    76.92

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    21

    Passes Ro3:
    N

    QED Weighted:
    0.05

    DETAILS
  11. ALA5289601

    Name:
    1-(6-((8-(4-((((3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yl)carbamoyl)oxy)Show More

    Mol. Formula:
    C59H73ClF2N5O3+

    M.W.:
    973.71

    Type:
    ---

    AlogP:
    14.06

    Polar Surface Area:
    76.92

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    22

    Passes Ro3:
    N

    QED Weighted:
    0.05

    DETAILS
  12. ALA5289083

    Name:
    1-(6-((3-((6-(4-((((3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yl)carbamoyl)Show More

    Mol. Formula:
    C60H76ClF2N6O3+

    M.W.:
    1002.76

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  13. ALA5287315

    Name:
    1-(hept-6-yn-1-yl)piperidin-4-yl (3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2Show More

    Mol. Formula:
    C25H27ClF2N2O2

    M.W.:
    460.95

    Type:
    ---

    AlogP:
    6.49

    Polar Surface Area:
    41.57

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  14. ALA5287159

    Name:
    3-(6-((3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-2,2-dimethylpropyl)diShow More

    Mol. Formula:
    C35H46N4O8

    M.W.:
    650.77

    Type:
    ---

    AlogP:
    4.52

    Polar Surface Area:
    83.35

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  15. ALA5287096

    Name:
    3-(6-((3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-2,2-dimethylpropyl)diShow More

    Mol. Formula:
    C36H50Br2N4O4

    M.W.:
    762.63

    Type:
    ---

    AlogP:
    5.17

    Polar Surface Area:
    72.49

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
  16. ALA5285668

    Name:
    3-(6-((3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-2,2-dimethylpropyl)diShow More

    Mol. Formula:
    C38H52N4O8

    M.W.:
    692.85

    Type:
    ---

    AlogP:
    5.17

    Polar Surface Area:
    72.49

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
  17. ALA5285607

    Name:
    5-(1-(5-(4-(6-(4-((((3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yl)carbamoylShow More

    Mol. Formula:
    C58H63ClF2N10O5

    M.W.:
    1053.66

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  18. ALA5284000

    Name:
    1-(8-aminooctyl)piperidin-4-yl (3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yShow More

    Mol. Formula:
    C26H34ClF2N3O2

    M.W.:
    494.03

    Type:
    ---

    AlogP:
    6.60

    Polar Surface Area:
    67.59

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  19. ALA5270870

    Name:
    (1-(8-aminooctyl)piperidin-4-yl)methyl (3'-chloro-4',5-difluoro-[1,1'-bipheShow More

    Mol. Formula:
    C27H36ClF2N3O2

    M.W.:
    508.05

    Type:
    ---

    AlogP:
    6.85

    Polar Surface Area:
    67.59

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  20. ALA5268503

    Name:
    5-(1-(5-(4-(5-(4-((((3'-chloro-4',5-difluoro-[1,1'-biphenyl]-2-yl)carbamoylShow More

    Mol. Formula:
    C57H61ClF2N10O5

    M.W.:
    1039.63

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
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