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  1. ALA4514691

    Name:
    (1R,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-(1-(benzo
    Show More

    Mol. Formula:
    C40H53N3O5

    M.W.:
    655.88

    Type:
    Unknown

    AlogP:
    8.27

    Polar Surface Area:
    92.54

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  2. ALA4514682

    Name:
    2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-(methylsulfo
    Show More

    Mol. Formula:
    C19H22ClN5O4S

    M.W.:
    451.94

    Type:
    Unknown

    AlogP:
    2.15

    Polar Surface Area:
    89.27

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  3. ALA4514658

    Name:
    6-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)hexyl (1S,2R,
    Show More

    Mol. Formula:
    C40H61FN2O5

    M.W.:
    668.94

    Type:
    Unknown

    AlogP:
    7.80

    Polar Surface Area:
    101.39

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  4. ALA4514527

    Name:
    N1-(2-(5-chloro-2,4-dimethoxyphenyl)-7-morpholinoi
    Show More

    Mol. Formula:
    C21H26ClN5O3

    M.W.:
    431.92

    Type:
    Unknown

    AlogP:
    2.88

    Polar Surface Area:
    86.28

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  5. ALA4514396

    Name:
    N-[(4S)-Isopropenylcychlohexene-1-carboxyl]-(-)-de
    Show More

    Mol. Formula:
    C30H35NO5S

    M.W.:
    521.68

    Type:
    Unknown

    AlogP:
    5.87

    Polar Surface Area:
    73.86

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  6. ALA4514359

    Name:
    2-(1-(2-(5-chloro-2,4-dimethoxyphenyl)imidazo[1,2-
    Show More

    Mol. Formula:
    C22H29Cl3N4O2

    M.W.:
    487.86

    Type:
    Unknown

    AlogP:
    4.24

    Polar Surface Area:
    65.02

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  7. ALA4514330

    Name:
    Octanedioic acid {4-[(2,4-dihydroxy-5-isopropyl-be
    Show More

    Mol. Formula:
    C25H33N3O6

    M.W.:
    471.55

    Type:
    Unknown

    AlogP:
    4.28

    Polar Surface Area:
    139.20

    HBA:
    6

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  8. ALA4514108

    Name:
    (S)-tert-butyl (1-(2-(5-chloro-2,4-dimethoxyphenyl
    Show More

    Mol. Formula:
    C23H28ClN5O4

    M.W.:
    473.96

    Type:
    Unknown

    AlogP:
    4.17

    Polar Surface Area:
    90.22

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  9. ALA4514060

    Name:
    2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-(pyrimidin-5
    Show More

    Mol. Formula:
    C24H25ClN6O2

    M.W.:
    464.96

    Type:
    Unknown

    AlogP:
    4.18

    Polar Surface Area:
    68.02

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  10. ALA4514054

    Name:
    4-Hydroxy-3-methyl-4-(3,4,5-trimethoxyphenyl)thiaz
    Show More

    Mol. Formula:
    C13H17NO4S2

    M.W.:
    315.42

    Type:
    Unknown

    AlogP:
    1.82

    Polar Surface Area:
    51.16

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  11. ALA4513940

    Name:
    (1R,4S,7R,10S,13S,14R,15E,17E,19R,21S)-4-((S)-Sec-
    Show More

    Mol. Formula:
    C41H53Cl2N3O9

    M.W.:
    802.79

    Type:
    Unknown

    AlogP:
    5.51

    Polar Surface Area:
    175.82

    HBA:
    9

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  12. ALA4513911

    Name:
    2-Oxo-2-((3-(picolinamido)phenyl)amino)ethyl-4-cyc
    Show More

    Mol. Formula:
    C25H31N5O2S2

    M.W.:
    497.69

    Type:
    Unknown

    AlogP:
    4.24

    Polar Surface Area:
    77.57

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  13. ALA4513874

    Name:
    (5R,5aR,8aS,9S)-5-(4-hydroxy-3,5-dimethoxyphenyl)-
    Show More

    Mol. Formula:
    C34H30N4O9

    M.W.:
    638.63

    Type:
    Unknown

    AlogP:
    4.28

    Polar Surface Area:
    156.40

    HBA:
    13

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  14. ALA4513810

    Name:
    2'-Amino-1-ethyl-5'-hydroxy-7-methyl-2,6'-dioxo-8'
    Show More

    Mol. Formula:
    C29H21N3O5

    M.W.:
    491.50

    Type:
    Unknown

    AlogP:
    4.21

    Polar Surface Area:
    129.79

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  15. ALA4513712

    Name:
    5-cyclopentyl-1-methyl-7-(4-(pyrrolidin-1-yl)pheny
    Show More

    Mol. Formula:
    C23H26N8O

    M.W.:
    430.52

    Type:
    Unknown

    AlogP:
    3.60

    Polar Surface Area:
    93.24

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  16. ALA4513636

    Name:
    Benzyl 3beta-[(L-leucine)amino]-11-oxo-olean-12-en
    Show More

    Mol. Formula:
    C43H64N2O4

    M.W.:
    673.00

    Type:
    Unknown

    AlogP:
    8.57

    Polar Surface Area:
    98.49

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  17. ALA4513600

    Name:
    4-(2-(4-2-(5-chloro-2,4-dimethoxyphenyl)imidazo[1,
    Show More

    Mol. Formula:
    C27H30ClN7O3

    M.W.:
    536.04

    Type:
    Unknown

    AlogP:
    3.63

    Polar Surface Area:
    80.49

    HBA:
    10

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  18. ALA4513575

    Name:
    2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-(cyclopropyl
    Show More

    Mol. Formula:
    C23H27ClN4O4S

    M.W.:
    491.01

    Type:
    Unknown

    AlogP:
    3.68

    Polar Surface Area:
    76.38

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  19. ALA4513549

    Name:
    ((2S*,3S*)-3-Cyano-3-methylaziridin-2-yl)phosphoni
    Show More

    Mol. Formula:
    C4H7N2O3P

    M.W.:
    162.09

    Type:
    Unknown

    AlogP:
    -0.62

    Polar Surface Area:
    103.26

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  20. ALA4513384

    Name:
    Tert-butyl 4-(3-bromo-2-(5-chloro-2,4-dimethoxyphe
    Show More

    Mol. Formula:
    C24H28BrClN4O4

    M.W.:
    551.87

    Type:
    Unknown

    AlogP:
    5.49

    Polar Surface Area:
    68.54

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
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