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  1. ALA4475631

    Name:
    3-(1-Benzyl-1H-tetrazol-5-yl)-1-(phenyl)-beta-carb
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    Mol. Formula:
    C25H18N6

    M.W.:
    402.46

    Type:
    Unknown

    AlogP:
    5.08

    Polar Surface Area:
    72.28

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  2. ALA4475086

    Name:
    2-(1H-Indol-2-yl)phenyl acetate

    Mol. Formula:
    C16H13NO2

    M.W.:
    251.28

    Type:
    Unknown

    AlogP:
    3.76

    Polar Surface Area:
    42.09

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  3. ALA4474335

    Name:
    3-(1H-Tetrazol-5-yl)-1-(p-fluorophenyl)-beta-carbo
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    Mol. Formula:
    C18H11FN6

    M.W.:
    330.33

    Type:
    Unknown

    AlogP:
    3.70

    Polar Surface Area:
    83.14

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  4. ALA4537660

    Name:
    Antcamphorol E

    Mol. Formula:
    C28H42O6

    M.W.:
    474.64

    Type:
    Unknown

    AlogP:
    3.88

    Polar Surface Area:
    115.06

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  5. ALA4521482

    Name:
    Antcamphorol D

    Mol. Formula:
    C28H42O6

    M.W.:
    474.64

    Type:
    Unknown

    AlogP:
    3.88

    Polar Surface Area:
    115.06

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  6. ALA4555787

    Name:
    Antcamphorol F

    Mol. Formula:
    C29H44O2

    M.W.:
    424.67

    Type:
    Unknown

    AlogP:
    6.90

    Polar Surface Area:
    37.30

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  7. ALA4553626

    Name:
    Antcamphorol H

    Mol. Formula:
    C29H46O2

    M.W.:
    426.69

    Type:
    Unknown

    AlogP:
    6.69

    Polar Surface Area:
    40.46

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  8. ALA4569151

    Name:
    2-(1H-Indol-2-yl)phenyl benzoate

    Mol. Formula:
    C21H15NO2

    M.W.:
    313.36

    Type:
    Unknown

    AlogP:
    5.05

    Polar Surface Area:
    42.09

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  9. ALA4528608

    Name:
    3-(1-Benzyl-1H-tetrazol-5-yl)-1-(p-fluorophenyl)-b
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    Mol. Formula:
    C25H17FN6

    M.W.:
    420.45

    Type:
    Unknown

    AlogP:
    5.22

    Polar Surface Area:
    72.28

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  10. ALA4526118

    Name:
    1-(5-(4-chlorophenyl)-3-(thiophen-2-yl)-4,5-dihydr
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    Mol. Formula:
    C24H19ClN4O2S2

    M.W.:
    495.03

    Type:
    Unknown

    AlogP:
    6.23

    Polar Surface Area:
    71.59

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  11. ALA4525906

    Name:
    (1S,2R,4aS,6aS,6bR,8aR,12aR,12bR,14bS,E)-11-(1-(2,
    Show More

    Mol. Formula:
    C52H61NO6

    M.W.:
    796.06

    Type:
    Unknown

    AlogP:
    11.79

    Polar Surface Area:
    130.85

    HBA:
    5

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  12. ALA4744324

    Name:
    4-[(tert-butylamino)methyl]-1,5-bis(4-chlorophenyl
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    Mol. Formula:
    C23H25Cl2N3O2

    M.W.:
    446.38

    Type:
    Unknown

    AlogP:
    5.91

    Polar Surface Area:
    56.15

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  13. ALA4743929

    Name:
    4-[(tert-butylamino)methyl]-1-(4-chlorophenyl)-3-e
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    Mol. Formula:
    C23H26ClN3O2

    M.W.:
    411.93

    Type:
    Unknown

    AlogP:
    5.26

    Polar Surface Area:
    56.15

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  14. ALA4743476

    Name:
    (ethane-1,2-diylbis(oxy))bis(ethane-2,1-diyl) bis(
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    Mol. Formula:
    C50H58N12O12

    M.W.:
    1019.09

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  15. ALA4743448

    Name:
    (3-amino-4-chlorophenyl)(4-(4-amino-6,7-dimethoxyq
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    Mol. Formula:
    C21H23ClN6O3

    M.W.:
    442.91

    Type:
    Unknown

    AlogP:
    2.43

    Polar Surface Area:
    119.83

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  16. ALA4741970

    Name:
    4-[(tert-butylamino)methyl]-3-carboxy-1-(4-chlorop
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    Mol. Formula:
    C22H24ClN3O3

    M.W.:
    413.91

    Type:
    Unknown

    AlogP:
    4.79

    Polar Surface Area:
    76.38

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  17. ALA4741336

    Name:
    4-[(tert-butylamino)methyl]-3-carboxy-1-(4-chlorop
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    Mol. Formula:
    C21H21ClN4O4

    M.W.:
    428.88

    Type:
    Unknown

    AlogP:
    4.69

    Polar Surface Area:
    110.29

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  18. ALA4740598

    Name:
    4-[(tert-butylamino)methyl]-1-(4-chlorophenyl)-3-e
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    Mol. Formula:
    C23H26Cl2N4O4

    M.W.:
    493.39

    Type:
    Unknown

    AlogP:
    5.17

    Polar Surface Area:
    99.29

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  19. ALA4764780

    Name:
    4-[(tert-butylamino)methyl]-3-carboxy-5-(4-fluorop
    Show More

    Mol. Formula:
    C21H22FN3O2

    M.W.:
    367.42

    Type:
    Unknown

    AlogP:
    4.26

    Polar Surface Area:
    67.15

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  20. ALA4764697

    Name:
    4-[(tert-butylamino)methyl]-3-ethoxycarbonyl-5-(4-
    Show More

    Mol. Formula:
    C24H30ClN3O3

    M.W.:
    443.98

    Type:
    Unknown

    AlogP:
    4.61

    Polar Surface Area:
    65.38

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
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