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  1. ALA5268625

    Name:
    2-(3-(2,5-dimethoxyphenyl)ureido)benzoic acid

    Mol. Formula:
    C16H16N2O5

    M.W.:
    316.31

    Type:
    ---

    AlogP:
    3.05

    Polar Surface Area:
    96.89

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  2. ALA5287674

    Name:
    3-((3',4'-dichloro-[1,1'-biphenyl])-3-sulfonamido)benzoic acid

    Mol. Formula:
    C19H13Cl2NO4S

    M.W.:
    422.29

    Type:
    ---

    AlogP:
    5.16

    Polar Surface Area:
    83.47

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  3. ALA2418570

    Name:
    3-((Z)-((Z)-3-ethyl-5-(4-(2-methoxy-2-oxoethoxy)benzylidene)-4-oxothiazolidShow More

    Mol. Formula:
    C22H20N2O6S

    M.W.:
    440.48

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    105.50

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  4. ALA2418569

    Name:
    3-((Z)-((Z)-5-(4-Hydroxybenzylidene)-3-ethyl-4-oxothiazolidin-2-ylidene)amiShow More

    Mol. Formula:
    C19H16N2O4S

    M.W.:
    368.41

    Type:
    Small molecule

    AlogP:
    3.71

    Polar Surface Area:
    90.20

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  5. ALA2418568

    Name:
    3-((Z)-((Z)-5-(4-Hydroxybenzylidene)-3-methyl-4-oxothiazolidin-2ylidene)amiShow More

    Mol. Formula:
    C18H14N2O4S

    M.W.:
    354.39

    Type:
    Small molecule

    AlogP:
    3.32

    Polar Surface Area:
    90.20

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  6. ALA2418567

    Name:
    3-((Z)-((Z)-5-(2-(carboxymethoxy)benzylidene)-3-isopropyl-4-oxothiazolidin-Show More

    Mol. Formula:
    C22H20N2O6S

    M.W.:
    440.48

    Type:
    Small molecule

    AlogP:
    3.86

    Polar Surface Area:
    116.50

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  7. ALA2418566

    Name:
    3-((Z)-((Z)-3-isopropyl-5-(2-(2-methoxy-2-oxoethoxy)benzylidene)-4-oxothiazShow More

    Mol. Formula:
    C23H22N2O6S

    M.W.:
    454.50

    Type:
    Small molecule

    AlogP:
    3.95

    Polar Surface Area:
    105.50

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  8. ALA2418565

    Name:
    3-((Z)-((Z)-3-allyl-5-(2-(carboxymethoxy)benzylidene)-4-oxothiazolidin-2-ylShow More

    Mol. Formula:
    C22H18N2O6S

    M.W.:
    438.46

    Type:
    Small molecule

    AlogP:
    3.64

    Polar Surface Area:
    116.50

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  9. ALA2418564

    Name:
    3-((Z)-((Z)-3-allyl-5-(2-(2-methoxy-2-oxoethoxy)benzylidene)-4-oxothiazolidShow More

    Mol. Formula:
    C23H20N2O6S

    M.W.:
    452.49

    Type:
    Small molecule

    AlogP:
    3.73

    Polar Surface Area:
    105.50

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  10. ALA2418563

    Name:
    3-((Z)-((Z)-5-(2-(carboxymethoxy)benzylidene)-3-ethyl-4-oxothiazolidin-2-ylShow More

    Mol. Formula:
    C21H18N2O6S

    M.W.:
    426.45

    Type:
    Small molecule

    AlogP:
    3.47

    Polar Surface Area:
    116.50

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  11. ALA2418562

    Name:
    3-((Z)-((Z)-3-ethyl-5-(2-(2-methoxy-2-oxoethoxy)benzylidene)-4-oxothiazolidShow More

    Mol. Formula:
    C22H20N2O6S

    M.W.:
    440.48

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    105.50

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  12. ALA2418561

    Name:
    3-((Z)-((Z)-3-ethyl-5-(2-hydroxybenzylidene)-4-oxothiazolidin-2-ylidene)amiShow More

    Mol. Formula:
    C19H16N2O4S

    M.W.:
    368.41

    Type:
    Small molecule

    AlogP:
    3.71

    Polar Surface Area:
    90.20

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  13. ALA2418560

    Name:
    3-((Z)-((Z)-5-(2-(2-methoxy-2-oxoethoxy)benzylidene)-3-methyl-4-oxothiazoliShow More

    Mol. Formula:
    C21H18N2O6S

    M.W.:
    426.45

    Type:
    Small molecule

    AlogP:
    3.17

    Polar Surface Area:
    105.50

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  14. ALA2418559

    Name:
    3-((Z)-((Z)-5-(2-hydroxybenzylidene)-3-methyl-4-oxothiazolidin-2-ylidene)amShow More

    Mol. Formula:
    C18H14N2O4S

    M.W.:
    354.39

    Type:
    Small molecule

    AlogP:
    3.32

    Polar Surface Area:
    90.20

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  15. ALA2418558

    Name:
    3-((Z)-((Z)-5-(2-(carboxymethoxy)benzylidene)-3-methyl-4-oxothiazolidin-2-yShow More

    Mol. Formula:
    C20H16N2O6S

    M.W.:
    412.42

    Type:
    Small molecule

    AlogP:
    3.08

    Polar Surface Area:
    116.50

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  16. ALA2418557

    Name:
    (2Z,5Z)-2-(3-acetylphenylimino)-3-ethyl-5-(4-hydroxybenzylidene)thiazolidinShow More

    Mol. Formula:
    C20H18N2O3S

    M.W.:
    366.44

    Type:
    Small molecule

    AlogP:
    4.22

    Polar Surface Area:
    69.97

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  17. ALA2418556

    Name:
    3-((Z)-((Z)-3-butyl-5-(4-(carboxymethoxy)benzylidene)-4-oxothiazolidin-2-ylShow More

    Mol. Formula:
    C23H22N2O6S

    M.W.:
    454.50

    Type:
    Small molecule

    AlogP:
    4.25

    Polar Surface Area:
    116.50

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  18. ALA2418555

    Name:
    3-((Z)-((Z)-3-butyl-5-(4-(2-methoxy-2-oxoethoxy)benzylidene)-4-oxothiazolidShow More

    Mol. Formula:
    C24H24N2O6S

    M.W.:
    468.53

    Type:
    Small molecule

    AlogP:
    4.34

    Polar Surface Area:
    105.50

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  19. ALA2418554

    Name:
    3-((Z)-((Z)-3-butyl-5-(4-hydroxybenzylidene)-4-oxothiazolidin-2-ylidene)amiShow More

    Mol. Formula:
    C21H20N2O4S

    M.W.:
    396.47

    Type:
    Small molecule

    AlogP:
    4.49

    Polar Surface Area:
    90.20

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  20. ALA2418553

    Name:
    3-((Z)-((Z)-5-(4-(carboxymethoxy)benzylidene)-3-isopropyl-4-oxothiazolidin-Show More

    Mol. Formula:
    C22H20N2O6S

    M.W.:
    440.48

    Type:
    Small molecule

    AlogP:
    3.86

    Polar Surface Area:
    116.50

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
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