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  1. ALA5286891

    Name:
    N-(benzo[d]thiazol-2-yl)-7-chloro-2-hydroxy-6-methoxyquinoline-4-carboxamidShow More

    Mol. Formula:
    C18H12ClN3O3S

    M.W.:
    385.83

    Type:
    ---

    AlogP:
    4.46

    Polar Surface Area:
    84.34

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  2. ALA5283595

    Name:
    N-(benzo[d]thiazol-2-yl)-2,6-dihydroxyquinoline-4-carboxamide

    Mol. Formula:
    C17H11N3O3S

    M.W.:
    337.36

    Type:
    ---

    AlogP:
    3.51

    Polar Surface Area:
    95.34

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  3. ALA5290600

    Name:
    Resorufin-7-O-phosphate

    Mol. Formula:
    C12H8NO6P

    M.W.:
    293.17

    Type:
    ---

    AlogP:
    1.76

    Polar Surface Area:
    109.86

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  4. ALA5266116

    Name:
    4-(((3-oxo-3H-phenoxazin-7-yl)oxy)methyl)phenyl dihydrogen phosphate

    Mol. Formula:
    C19H14NO7P

    M.W.:
    399.30

    Type:
    ---

    AlogP:
    3.34

    Polar Surface Area:
    119.09

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  5. ALA3198436

    Name:
    SID856482

    Mol. Formula:
    C14H27N4O4P

    M.W.:
    346.37

    Type:
    Small molecule

    AlogP:
    1.07

    Polar Surface Area:
    77.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  6. ALA1737011

    Name:
    SID56373731

    Mol. Formula:
    C11H9Cl4NO4

    M.W.:
    361.01

    Type:
    Small molecule

    AlogP:
    3.88

    Polar Surface Area:
    56.79

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  7. ALA1736975

    Name:
    SID56373922

    Mol. Formula:
    C11H16ClNO3

    M.W.:
    245.71

    Type:
    Small molecule

    AlogP:
    1.28

    Polar Surface Area:
    69.56

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  8. ALA1736852

    Name:
    SID56373506

    Mol. Formula:
    C14H17F3N2O3

    M.W.:
    318.30

    Type:
    Small molecule

    AlogP:
    3.12

    Polar Surface Area:
    50.80

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.93

    DETAILS
  9. ALA1736776

    Name:
    SID57287586

    Mol. Formula:
    C21H15ClN4O3S

    M.W.:
    438.90

    Type:
    Small molecule

    AlogP:
    4.37

    Polar Surface Area:
    101.13

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  10. ALA1735993

    Name:
    SID57309192

    Mol. Formula:
    C15H17NO4

    M.W.:
    275.30

    Type:
    Small molecule

    AlogP:
    2.28

    Polar Surface Area:
    82.70

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  11. ALA1735198

    Name:
    SID57287654

    Mol. Formula:
    C19H21N3O2

    M.W.:
    323.40

    Type:
    Small molecule

    AlogP:
    3.66

    Polar Surface Area:
    53.93

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  12. ALA1734946

    Name:
    SID57309184

    Mol. Formula:
    C16H15N3O3

    M.W.:
    297.31

    Type:
    Small molecule

    AlogP:
    2.28

    Polar Surface Area:
    87.38

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  13. ALA1734721

    Name:
    SID57287606

    Mol. Formula:
    C17H16N2O3

    M.W.:
    296.33

    Type:
    Small molecule

    AlogP:
    2.22

    Polar Surface Area:
    81.59

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  14. ALA1733841

    Name:
    SID56373579

    Mol. Formula:
    C16H13N3O3S

    M.W.:
    327.37

    Type:
    Small molecule

    AlogP:
    2.86

    Polar Surface Area:
    99.10

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  15. ALA1732820

    Name:
    SID57309185

    Mol. Formula:
    C12H12N2O3S

    M.W.:
    264.31

    Type:
    Small molecule

    AlogP:
    1.81

    Polar Surface Area:
    75.35

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  16. ALA1732579

    Name:
    SID56373633

    Mol. Formula:
    C17H15N3O4S

    M.W.:
    357.39

    Type:
    Small molecule

    AlogP:
    2.73

    Polar Surface Area:
    116.43

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  17. ALA1732408

    Name:
    SID81066599

    Mol. Formula:
    C16H15N5O3

    M.W.:
    325.33

    Type:
    Small molecule

    AlogP:
    2.14

    Polar Surface Area:
    112.91

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  18. ALA1732263

    Name:
    SID57287607

    Mol. Formula:
    C18H14FN3O3

    M.W.:
    339.33

    Type:
    Small molecule

    AlogP:
    2.67

    Polar Surface Area:
    91.14

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  19. ALA1731432

    Name:
    SID56373639

    Mol. Formula:
    C17H15N3O4S

    M.W.:
    357.39

    Type:
    Small molecule

    AlogP:
    2.87

    Polar Surface Area:
    108.33

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  20. ALA1731166

    Name:
    SID48410186

    Mol. Formula:
    C17H14FNO3S

    M.W.:
    331.37

    Type:
    Small molecule

    AlogP:
    3.79

    Polar Surface Area:
    55.40

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
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