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  1. ALA4513270

    Name:
    2,7-bis(3-(dimethylamino)propyl)-4-(3-(4-(2-((2S,3
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    Mol. Formula:
    C37H50N8O10

    M.W.:
    766.85

    Type:
    Unknown

    AlogP:
    -0.61

    Polar Surface Area:
    223.36

    HBA:
    16

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    18

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
  2. ALA4483655

    Name:
    3-(2-(3,7-dimethylocta-2,6-dienyloxy)phenyl)-1-phe
    Show More

    Mol. Formula:
    C25H28O2

    M.W.:
    360.50

    Type:
    Unknown

    AlogP:
    6.65

    Polar Surface Area:
    26.30

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  3. ALA4474468

    Name:
    2-([1,4'-Bipiperidin]-1'-yl)-5-(1-methyl-5-nitro-1
    Show More

    Mol. Formula:
    C16H23N7O2S

    M.W.:
    377.47

    Type:
    Unknown

    AlogP:
    2.30

    Polar Surface Area:
    93.22

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  4. ALA4535951

    Name:
    2-([1,4'-Bipiperidine]-1'-yl)-5-(5-nitrofuran-2-yl
    Show More

    Mol. Formula:
    C16H22ClN5O3S

    M.W.:
    399.90

    Type:
    Unknown

    AlogP:
    3.16

    Polar Surface Area:
    88.54

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  5. ALA4532108

    Name:
    2-(2-Methyl-6-(3,4,5-trimethoxyphenyl)nicotinoyl)-
    Show More

    Mol. Formula:
    C24H26N4O4S

    M.W.:
    466.56

    Type:
    Unknown

    AlogP:
    4.02

    Polar Surface Area:
    93.74

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  6. ALA4556617

    Name:
    2,4,7-tris(3-(dimethylamino)propyl)-9-(3-(4-(2-((2
    Show More

    Mol. Formula:
    C42H61N9O10

    M.W.:
    852.00

    Type:
    Unknown

    AlogP:
    -0.12

    Polar Surface Area:
    226.60

    HBA:
    17

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    22

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  7. ALA4569225

    Name:
    N-(4-Chlorophenyl)-2-(6-(3,4-dimethoxyphenyl)-2-me
    Show More

    Mol. Formula:
    C22H21ClN4O4

    M.W.:
    440.89

    Type:
    Unknown

    AlogP:
    4.19

    Polar Surface Area:
    101.58

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  8. ALA4567831

    Name:
    N-(4-Chlorophenyl)-2-(6-(4-methoxyphenyl)-2-methyl
    Show More

    Mol. Formula:
    C21H19ClN4O2S

    M.W.:
    426.93

    Type:
    Unknown

    AlogP:
    4.35

    Polar Surface Area:
    75.28

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  9. ALA4528864

    Name:
    N'-(3-(2,3-dimethylphenyl)-4-(2-oxo-2H-chromen-3-y
    Show More

    Mol. Formula:
    C30H21N3O5S

    M.W.:
    535.58

    Type:
    Unknown

    AlogP:
    5.28

    Polar Surface Area:
    106.81

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  10. ALA4527280

    Name:
    4-(3-(4-(((2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydrox
    Show More

    Mol. Formula:
    C42H58N8O15

    M.W.:
    914.97

    Type:
    Unknown

    AlogP:
    -2.83

    Polar Surface Area:
    302.51

    HBA:
    21

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    20

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
  11. ALA4549176

    Name:
    4-(3-(4-((2-(2-(2-((2R,3R,4R,5S,6R)-3,4-dihydroxy-
    Show More

    Mol. Formula:
    C53H81N9O18

    M.W.:
    1132.28

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  12. ALA4546429

    Name:
    2-(6-(3,4-Dimethoxyphenyl)-2-methylnicotinoyl)-N-(
    Show More

    Mol. Formula:
    C23H24N4O5

    M.W.:
    436.47

    Type:
    Unknown

    AlogP:
    3.55

    Polar Surface Area:
    110.81

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  13. ALA4573495

    Name:
    2-(6-(4-Methoxyphenyl)-2-methylnicotinoyl)-N-pheny
    Show More

    Mol. Formula:
    C21H20N4O3

    M.W.:
    376.42

    Type:
    Unknown

    AlogP:
    3.53

    Polar Surface Area:
    92.35

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  14. ALA4571916

    Name:
    2,4,7-tris(3-(dimethylamino)propyl)-9-(3-(4-((2-(2
    Show More

    Mol. Formula:
    C47H71N9O13

    M.W.:
    970.13

    Type:
    Unknown

    AlogP:
    -0.11

    Polar Surface Area:
    254.29

    HBA:
    20

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    30

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
  15. ALA4581063

    Name:
    2,4,7-tris(3-(dimethylamino)propyl)-9-(3-(4-((2-(2
    Show More

    Mol. Formula:
    C47H71N9O13

    M.W.:
    970.13

    Type:
    Unknown

    AlogP:
    -0.11

    Polar Surface Area:
    254.29

    HBA:
    20

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    30

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
  16. ALA4578528

    Name:
    N-(4-Methoxyphenyl)-2-(6-(4-methoxyphenyl)-2-methy
    Show More

    Mol. Formula:
    C22H22N4O4

    M.W.:
    406.44

    Type:
    Unknown

    AlogP:
    3.54

    Polar Surface Area:
    101.58

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  17. ALA4577676

    Name:
    2-(2-Methyl-6-(3,4,5-trimethoxyphenyl)nicotinoyl)-
    Show More

    Mol. Formula:
    C23H24N4O4S

    M.W.:
    452.54

    Type:
    Unknown

    AlogP:
    3.71

    Polar Surface Area:
    93.74

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  18. ALA4780574

    Name:
    2-ethyl-6-(4-nitrophenyl)imidazo[2,1-b][1,3,4]thia
    Show More

    Mol. Formula:
    C13H10N4O3S

    M.W.:
    302.31

    Type:
    Unknown

    AlogP:
    2.74

    Polar Surface Area:
    90.40

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  19. ALA4777463

    Name:
    3-((5aR,8R,9aR)-5,5,8-trimethyl-2-oxo-5a,6,7,8,9,9
    Show More

    Mol. Formula:
    C16H22N2OS2

    M.W.:
    322.50

    Type:
    Unknown

    AlogP:
    4.23

    Polar Surface Area:
    45.79

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  20. ALA4582661

    Name:
    4-(3-(4-(2-((2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydr
    Show More

    Mol. Formula:
    C43H60N8O15

    M.W.:
    928.99

    Type:
    Unknown

    AlogP:
    -2.79

    Polar Surface Area:
    302.51

    HBA:
    21

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    21

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
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