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  1. ALA5289085

    Name:
    Chrotacumine K

    Mol. Formula:
    C18H21NO6

    M.W.:
    347.37

    Type:
    ---

    AlogP:
    1.86

    Polar Surface Area:
    100.21

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  2. ALA1092123

    Name:
    (3-fluorophenyl)(2-hydroxy-4,6-dimethoxy-3-(pyrrol
    Show More

    Mol. Formula:
    C20H22FNO4

    M.W.:
    359.40

    Type:
    Small molecule

    AlogP:
    3.38

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  3. ALA1091429

    Name:
    (3-fluorophenyl)(2-hydroxy-4,6-dimethoxy-3-(piperi
    Show More

    Mol. Formula:
    C21H24FNO4

    M.W.:
    373.42

    Type:
    Small molecule

    AlogP:
    3.77

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  4. ALA1091435

    Name:
    (3-fluorophenyl)(2-hydroxy-4,6-dimethoxy-3-(morpho
    Show More

    Mol. Formula:
    C20H22FNO5

    M.W.:
    375.40

    Type:
    Small molecule

    AlogP:
    2.61

    Polar Surface Area:
    68.23

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  5. ALA1091050

    Name:
    (3-fluorophenyl)(2-hydroxy-4,6-dimethoxy-3-((4-met
    Show More

    Mol. Formula:
    C21H25FN2O4

    M.W.:
    388.44

    Type:
    Small molecule

    AlogP:
    2.53

    Polar Surface Area:
    62.24

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  6. ALA1091049

    Name:
    (2-bromophenyl)(2-hydroxy-4,6-dimethoxy-3-(pyrroli
    Show More

    Mol. Formula:
    C20H22BrNO4

    M.W.:
    420.30

    Type:
    Small molecule

    AlogP:
    4.00

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  7. ALA1091048

    Name:
    (2-bromophenyl)(2-hydroxy-4,6-dimethoxy-3-(piperid
    Show More

    Mol. Formula:
    C21H24BrNO4

    M.W.:
    434.33

    Type:
    Small molecule

    AlogP:
    4.39

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  8. ALA1088969

    Name:
    (2-bromophenyl)(2-hydroxy-4,6-dimethoxy-3-(morphol
    Show More

    Mol. Formula:
    C20H22BrNO5

    M.W.:
    436.30

    Type:
    Small molecule

    AlogP:
    3.24

    Polar Surface Area:
    68.23

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  9. ALA1093734

    Name:
    (2-bromophenyl)(2-hydroxy-4,6-dimethoxy-3-((4-meth
    Show More

    Mol. Formula:
    C21H25BrN2O4

    M.W.:
    449.35

    Type:
    Small molecule

    AlogP:
    3.15

    Polar Surface Area:
    62.24

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  10. ALA1093733

    Name:
    (3-chlorophenyl)(2-hydroxy-4,6-dimethoxy-3-(pyrrol
    Show More

    Mol. Formula:
    C20H22ClNO4

    M.W.:
    375.85

    Type:
    Small molecule

    AlogP:
    3.89

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  11. ALA1093732

    Name:
    (3-chlorophenyl)(2-hydroxy-4,6-dimethoxy-3-(piperi
    Show More

    Mol. Formula:
    C21H24ClNO4

    M.W.:
    389.88

    Type:
    Small molecule

    AlogP:
    4.28

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  12. ALA1093731

    Name:
    (3-chlorophenyl)(2-hydroxy-4,6-dimethoxy-3-(morpho
    Show More

    Mol. Formula:
    C20H22ClNO5

    M.W.:
    391.85

    Type:
    Small molecule

    AlogP:
    3.13

    Polar Surface Area:
    68.23

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  13. ALA1093374

    Name:
    6-(1-Hydroxy-1,3-dihydrobenzo[c][1,2]oxaborol-5-yl
    Show More

    Cas Number:
    1187187-03-6

    Mol. Formula:
    C13H10BNO5

    M.W.:
    271.04

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  14. ALA1093060

    Name:
    (3-chlorophenyl)(2-hydroxy-4,6-dimethoxy-3-((4-met
    Show More

    Mol. Formula:
    C21H25ClN2O4

    M.W.:
    404.89

    Type:
    Small molecule

    AlogP:
    3.04

    Polar Surface Area:
    62.24

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  15. ALA1089358

    Name:
    (2-fluorophenyl)(2-hydroxy-4,6-dimethoxy-3-(pyrrol
    Show More

    Mol. Formula:
    C20H22FNO4

    M.W.:
    359.40

    Type:
    Small molecule

    AlogP:
    3.38

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  16. ALA1089357

    Name:
    (2-fluorophenyl)(2-hydroxy-4,6-dimethoxy-3-(piperi
    Show More

    Mol. Formula:
    C21H24FNO4

    M.W.:
    373.42

    Type:
    Small molecule

    AlogP:
    3.77

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  17. ALA1089356

    Name:
    (2-fluorophenyl)(2-hydroxy-4,6-dimethoxyphenyl)met
    Show More

    Mol. Formula:
    C15H13FO4

    M.W.:
    276.26

    Type:
    Small molecule

    AlogP:
    2.78

    Polar Surface Area:
    55.76

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  18. ALA1089355

    Name:
    (3-chlorophenyl)(2-hydroxy-4,6-dimethoxyphenyl)met
    Show More

    Mol. Formula:
    C15H13ClO4

    M.W.:
    292.72

    Type:
    Small molecule

    AlogP:
    3.29

    Polar Surface Area:
    55.76

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  19. ALA1093944

    Name:
    (2-bromophenyl)(2-hydroxy-4,6-dimethoxyphenyl)meth
    Show More

    Mol. Formula:
    C15H13BrO4

    M.W.:
    337.17

    Type:
    Small molecule

    AlogP:
    3.40

    Polar Surface Area:
    55.76

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  20. ALA1093048

    Name:
    (3-fluorophenyl)(2-hydroxy-4,6-dimethoxyphenyl)met
    Show More

    Mol. Formula:
    C15H13FO4

    M.W.:
    276.26

    Type:
    Small molecule

    AlogP:
    2.78

    Polar Surface Area:
    55.76

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
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