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  1. ALA4878050

    Name:
    1-(4-Acetoxy-2-oxabutyl)-5-bromouracil

    Mol. Formula:
    C9H13BrN2O5

    M.W.:
    309.12

    Type:
    Unknown

    AlogP:
    0.10

    Polar Surface Area:
    88.10

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  2. ALA4876888

    Name:
    3-(beta-D-2-deoxyribofuranosyl)-8-nonyloxy-10-meth
    Show More

    Mol. Formula:
    C25H35N3O6

    M.W.:
    473.57

    Type:
    Unknown

    AlogP:
    3.89

    Polar Surface Area:
    106.28

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  3. ALA4876346

    Name:
    3-(beta-D-2-deoxyribofuranosyl)-8-octyloxy-10-meth
    Show More

    Mol. Formula:
    C24H33N3O6

    M.W.:
    459.54

    Type:
    Unknown

    AlogP:
    3.50

    Polar Surface Area:
    106.28

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  4. ALA4875977

    Name:
    3-(4-Hydroxy-2-oxabutyl)-10-methyl-1,3-diaza-2-oxo
    Show More

    Mol. Formula:
    C14H15N3O4

    M.W.:
    289.29

    Type:
    Unknown

    AlogP:
    1.08

    Polar Surface Area:
    76.82

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  5. ALA4873788

    Name:
    3-(4'-hydroxy-2'-cyclopenten-10-yl)-1,3-diaza-2-ox
    Show More

    Mol. Formula:
    C15H13N3O3

    M.W.:
    283.29

    Type:
    Unknown

    AlogP:
    1.95

    Polar Surface Area:
    76.38

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  6. ALA4873641

    Name:
    3-(beta-D-2-deoxyribofuranosyl)-10-methyl-1,3-diaz
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    Mol. Formula:
    C16H17N3O5

    M.W.:
    331.33

    Type:
    Unknown

    AlogP:
    0.76

    Polar Surface Area:
    97.05

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  7. ALA4872020

    Name:
    3-[4-(4,4'-Dimethoxytrityloxy)-2-oxabutyl]-1,3-dia
    Show More

    Mol. Formula:
    C34H31N3O6

    M.W.:
    577.64

    Type:
    Unknown

    AlogP:
    6.09

    Polar Surface Area:
    93.07

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
  8. ALA4870983

    Name:
    3-[4-(4,4'-Dimethoxytrityloxy)-2-oxabutyl]-10-meth
    Show More

    Mol. Formula:
    C35H33N3O6

    M.W.:
    591.66

    Type:
    Unknown

    AlogP:
    6.12

    Polar Surface Area:
    84.28

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  9. ALA5285206

    Name:
    1-hexadecyl-3-methoxypyridinium bromide

    Mol. Formula:
    C22H40BrNO

    M.W.:
    414.47

    Type:
    ---

    AlogP:
    6.46

    Polar Surface Area:
    13.11

    HBA:
    1

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  10. ALA5282193

    Name:
    1-(2-hydroxyethyl)-1-tetradecylimidazolium bromide

    Mol. Formula:
    C19H37BrN2O

    M.W.:
    389.42

    Type:
    ---

    AlogP:
    5.01

    Polar Surface Area:
    32.59

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  11. ALA5280868

    Name:
    N,N-dimethyl-N-hexadecyl-N-octylamonium bromide

    Mol. Formula:
    C26H56BrN

    M.W.:
    462.65

    Type:
    ---

    AlogP:
    8.90

    Polar Surface Area:
    0.00

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    22

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  12. ALA4868090

    Name:
    3-((2R,4S,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro
    Show More

    Mol. Formula:
    C15H15N3O5

    M.W.:
    317.30

    Type:
    Unknown

    AlogP:
    0.73

    Polar Surface Area:
    105.84

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  13. ALA4867320

    Name:
    3-(beta-D-2-deoxyribofuranosyl)-8-decyloxy-10-meth
    Show More

    Mol. Formula:
    C26H37N3O6

    M.W.:
    487.60

    Type:
    Unknown

    AlogP:
    4.28

    Polar Surface Area:
    106.28

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  14. ALA4865141

    Name:
    1-[4-(4,4'-Dimethoxytrityloxy)-2-oxabutyl]-5-bromo
    Show More

    Mol. Formula:
    C28H29BrN2O6

    M.W.:
    569.45

    Type:
    Unknown

    AlogP:
    4.57

    Polar Surface Area:
    89.49

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  15. ALA4857025

    Name:
    3-(4-Hydroxy-2-oxabutyl)-1,3-diaza-2-oxophenoxazin
    Show More

    Mol. Formula:
    C13H13N3O4

    M.W.:
    275.26

    Type:
    Unknown

    AlogP:
    1.06

    Polar Surface Area:
    85.61

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  16. ALA4859942

    Name:
    3-(beta-D-2-deoxyribofuranosyl)-8-decyloxy-1,3-dia
    Show More

    Mol. Formula:
    C25H35N3O6

    M.W.:
    473.57

    Type:
    Unknown

    AlogP:
    4.25

    Polar Surface Area:
    115.07

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  17. ALA4862620

    Name:
    3-(4-Hydroxy-2-oxabutyl)-8-nonyloxy-1,3-diaza-2-ox
    Show More

    Mol. Formula:
    C22H31N3O5

    M.W.:
    417.51

    Type:
    Unknown

    AlogP:
    4.19

    Polar Surface Area:
    94.84

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  18. ALA2282171

    Name:
    3,3'-(4,4'-diphenyl)bissydnonyl methane

    Mol. Formula:
    C17H12N4O4

    M.W.:
    336.31

    Type:
    Small molecule

    AlogP:
    -0.05

    Polar Surface Area:
    105.94

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  19. ALA4846008

    Name:
    1-(4-Hydroxy-2-oxabutyl)-5-bromouracil

    Mol. Formula:
    C7H11BrN2O4

    M.W.:
    267.08

    Type:
    Unknown

    AlogP:
    -0.47

    Polar Surface Area:
    82.03

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  20. ALA4777798

    Name:
    3-(3',5'-di-O-acetyl-2'-deoxy-beta-D-ribofuranosyl
    Show More

    Mol. Formula:
    C25H24N2O8

    M.W.:
    480.47

    Type:
    Unknown

    AlogP:
    2.09

    Polar Surface Area:
    130.09

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
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