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  1. ALA4876394

    Name:
    N-(5,6-Dihydroxybenzo[d]thiazol-2-yl)-2,2-diphenyl
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    Mol. Formula:
    C21H16N2O3S

    M.W.:
    376.44

    Type:
    Unknown

    AlogP:
    4.48

    Polar Surface Area:
    82.45

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  2. ALA4875980

    Name:
    Methyl 3-thiosemicarbazone-18beta-olean-12-en-30-o
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    Mol. Formula:
    C32H51N3O2S

    M.W.:
    541.85

    Type:
    Unknown

    AlogP:
    7.15

    Polar Surface Area:
    76.71

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  3. ALA4875833

    Name:
    Methyl 1,2,3-thiadiazolor4,5-b]-18betaH-olean-12-e
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    Mol. Formula:
    C31H46N2O2S

    M.W.:
    510.79

    Type:
    Unknown

    AlogP:
    7.53

    Polar Surface Area:
    52.08

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  4. ALA4870229

    Name:
    3beta-acetoxy-11-oxo-18betaH-olean-12-en-30-oic ac
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    Mol. Formula:
    C37H52N2O4

    M.W.:
    588.83

    Type:
    Unknown

    AlogP:
    7.93

    Polar Surface Area:
    85.36

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  5. ALA4870122

    Name:
    Methyl 3-semicarbazone-11-oxo-18betaH-olean-12-en-
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    Mol. Formula:
    C32H49N3O4

    M.W.:
    539.76

    Type:
    Unknown

    AlogP:
    6.16

    Polar Surface Area:
    110.85

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  6. ALA5287287

    Name:
    (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-5-(5-((2-
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    Mol. Formula:
    C22H22FN3O4

    M.W.:
    411.43

    Type:
    ---

    AlogP:
    2.13

    Polar Surface Area:
    89.63

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  7. ALA5286612

    Name:
    (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-
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    Mol. Formula:
    C21H21FN4O3

    M.W.:
    396.42

    Type:
    ---

    AlogP:
    1.82

    Polar Surface Area:
    93.29

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  8. ALA5284240

    Name:
    (2R,3R,4R,5R)-5-(5-((4-bromophenyl)ethynyl)-4-meth
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    Mol. Formula:
    C21H19BrFN3O3

    M.W.:
    460.30

    Type:
    ---

    AlogP:
    2.88

    Polar Surface Area:
    80.40

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  9. ALA5284233

    Name:
    (2R,3R,4R,5R)-5-(5-(3,3-dimethylbut-1-yn-1-yl)-4-m
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    Mol. Formula:
    C19H24FN3O3

    M.W.:
    361.42

    Type:
    ---

    AlogP:
    2.12

    Polar Surface Area:
    80.40

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  10. ALA5283922

    Name:
    (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-5-(5-((4-
    Show More

    Mol. Formula:
    C22H22FN3O4

    M.W.:
    411.43

    Type:
    ---

    AlogP:
    2.13

    Polar Surface Area:
    89.63

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  11. ALA5283594

    Name:
    (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-5-(5-((6-
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    Mol. Formula:
    C21H21FN4O4

    M.W.:
    412.42

    Type:
    ---

    AlogP:
    1.52

    Polar Surface Area:
    102.52

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  12. ALA5282843

    Name:
    (4S,E)-3-(2-((1R,4aS,5R,8aS)-6-hydroxy-5-(hydroxym
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    Mol. Formula:
    C29H35NO5

    M.W.:
    477.60

    Type:
    ---

    AlogP:
    4.60

    Polar Surface Area:
    88.88

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  13. ALA5282223

    Name:
    (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-
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    Mol. Formula:
    C22H22FN3O3

    M.W.:
    395.43

    Type:
    ---

    AlogP:
    2.43

    Polar Surface Area:
    80.40

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  14. ALA5281877

    Name:
    (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-
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    Mol. Formula:
    C19H18FN5O3

    M.W.:
    383.38

    Type:
    ---

    AlogP:
    0.91

    Polar Surface Area:
    106.18

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  15. ALA5279697

    Name:
    (2R,3R,4R,5R)-5-(5-ethynyl-4-methyl-7H-pyrrolo[2,3
    Show More

    Mol. Formula:
    C15H16FN3O3

    M.W.:
    305.31

    Type:
    ---

    AlogP:
    0.70

    Polar Surface Area:
    80.40

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  16. ALA5279309

    Name:
    (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-
    Show More

    Mol. Formula:
    C22H24FN3O3

    M.W.:
    397.45

    Type:
    ---

    AlogP:
    2.99

    Polar Surface Area:
    80.40

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  17. ALA5278801

    Name:
    (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-
    Show More

    Mol. Formula:
    C22H22FN3O3

    M.W.:
    395.43

    Type:
    ---

    AlogP:
    2.43

    Polar Surface Area:
    80.40

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  18. ALA4865221

    Name:
    3beta-acetoxy-11-oxo-18beta11-olean-12-en-30-oic a
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    Mol. Formula:
    C41H54N2O4

    M.W.:
    638.89

    Type:
    Unknown

    AlogP:
    9.09

    Polar Surface Area:
    85.36

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  19. ALA4864689

    Name:
    N-(5,6-Dimethoxy-benzothiazol-2-yl)-2,2-diphenyl-a
    Show More

    Mol. Formula:
    C23H20N2O3S

    M.W.:
    404.49

    Type:
    Unknown

    AlogP:
    5.08

    Polar Surface Area:
    60.45

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  20. ALA4864423

    Name:
    1,2,3-thiadiazole-30-methy 3beta-hydroxy-11-oxo-18
    Show More

    Mol. Formula:
    C31H44N2O3S

    M.W.:
    524.77

    Type:
    Unknown

    AlogP:
    6.71

    Polar Surface Area:
    69.15

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
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