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  1. ALA5287605

    Name:
    Clonoamide

    Mol. Formula:
    C15H25NO2

    M.W.:
    251.37

    Type:
    ---

    AlogP:
    3.16

    Polar Surface Area:
    46.17

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  2. ALA5285975

    Name:

    Mol. Formula:
    C37H51NO9

    M.W.:
    653.81

    Type:
    ---

    AlogP:
    3.42

    Polar Surface Area:
    145.70

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  3. ALA5284960

    Name:
    1-(3-((2s,5s)-2-(4,5-diphenyl-1H-imidazol-2-yl)-1,
    Show More

    Mol. Formula:
    C27H30N4O2

    M.W.:
    442.56

    Type:
    ---

    AlogP:
    5.70

    Polar Surface Area:
    64.96

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  4. ALA5284543

    Name:
    trans-1-(4-(2-(4,5-diphenyl-1H-imidazol-2-yl)-1,3-
    Show More

    Mol. Formula:
    C28H32N4O2

    M.W.:
    456.59

    Type:
    ---

    AlogP:
    6.09

    Polar Surface Area:
    64.96

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  5. ALA5284134

    Name:
    1-(2-(2,6-dihydroxy-3-(3-methylbut-2-enyl)benzoyl)
    Show More

    Mol. Formula:
    C23H26O5

    M.W.:
    382.46

    Type:
    ---

    AlogP:
    4.69

    Polar Surface Area:
    94.83

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  6. ALA5283833

    Name:
    Voluhemin A

    Mol. Formula:
    C37H51NO8

    M.W.:
    637.81

    Type:
    ---

    AlogP:
    4.45

    Polar Surface Area:
    125.47

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  7. ALA5280709

    Name:
    Voluhemin B

    Mol. Formula:
    C38H53NO8

    M.W.:
    651.84

    Type:
    ---

    AlogP:
    5.10

    Polar Surface Area:
    114.47

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  8. ALA1098073

    Name:
    1-((1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfonyl)-4
    Show More

    Mol. Formula:
    C28H30N2O8S

    M.W.:
    554.62

    Type:
    Small molecule

    AlogP:
    3.80

    Polar Surface Area:
    107.75

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  9. ALA1098072

    Name:
    1-((1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfonyl)-4
    Show More

    Mol. Formula:
    C28H30N2O9S

    M.W.:
    570.62

    Type:
    Small molecule

    AlogP:
    3.50

    Polar Surface Area:
    116.98

    HBA:
    10

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  10. ALA1094099

    Name:
    N-(3-chlorobenzyl)-(1,3,6,7-Tetramethoxyxanthone-4
    Show More

    Mol. Formula:
    C24H22ClNO8S

    M.W.:
    519.96

    Type:
    Small molecule

    AlogP:
    4.11

    Polar Surface Area:
    113.30

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  11. ALA1095086

    Name:
    N-(2-naphthyl)-methyl-(1,3,6,7-Tetramethoxyxanthon
    Show More

    Mol. Formula:
    C28H25NO8S

    M.W.:
    535.57

    Type:
    Small molecule

    AlogP:
    4.61

    Polar Surface Area:
    113.30

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  12. ALA1096716

    Name:
    N-(4-fluorobenzyl)-(1,3,6,7-Tetramethoxyxanthone-4
    Show More

    Mol. Formula:
    C24H22FNO8S

    M.W.:
    503.50

    Type:
    Small molecule

    AlogP:
    3.60

    Polar Surface Area:
    113.30

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  13. ALA1096715

    Name:
    4-((1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfonyl)-(
    Show More

    Mol. Formula:
    C23H27NO9S

    M.W.:
    493.53

    Type:
    Small molecule

    AlogP:
    2.78

    Polar Surface Area:
    113.74

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  14. ALA1096392

    Name:
    1-((1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfonyl)-3
    Show More

    Mol. Formula:
    C23H28N2O8S

    M.W.:
    492.55

    Type:
    Small molecule

    AlogP:
    2.31

    Polar Surface Area:
    107.75

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  15. ALA1097386

    Name:
    1-((1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfonyl)-4
    Show More

    Mol. Formula:
    C22H26N2O8S

    M.W.:
    478.52

    Type:
    Small molecule

    AlogP:
    1.92

    Polar Surface Area:
    107.75

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  16. ALA1097385

    Name:
    1-((1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfonyl)-3
    Show More

    Mol. Formula:
    C27H34N2O9S

    M.W.:
    562.64

    Type:
    Small molecule

    AlogP:
    3.25

    Polar Surface Area:
    124.82

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  17. ALA1098394

    Name:
    1-((1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfonyl)-3
    Show More

    Mol. Formula:
    C25H29NO10S

    M.W.:
    535.57

    Type:
    Small molecule

    AlogP:
    2.94

    Polar Surface Area:
    130.81

    HBA:
    10

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  18. ALA1098393

    Name:
    1-((1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfonyl)-p
    Show More

    Mol. Formula:
    C22H25NO8S

    M.W.:
    463.51

    Type:
    Small molecule

    AlogP:
    3.16

    Polar Surface Area:
    104.51

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  19. ALA1094082

    Name:
    N-propyl-(1,3,6,7-Tetramethoxyxanthone-4-yl)-sulfo
    Show More

    Mol. Formula:
    C20H23NO8S

    M.W.:
    437.47

    Type:
    Small molecule

    AlogP:
    2.67

    Polar Surface Area:
    113.30

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  20. ALA1094081

    Name:
    N-cyclopropyl-(1,3,6,7-Tetramethoxyxanthone-4-yl)-
    Show More

    Mol. Formula:
    C20H21NO8S

    M.W.:
    435.45

    Type:
    Small molecule

    AlogP:
    2.42

    Polar Surface Area:
    113.30

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
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