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  1. ALA2289747

    Name:
    Emamectin benzoate

    Mol. Formula:
    C56H81NO15

    M.W.:
    1008.26

    Type:
    Small molecule

    AlogP:
    5.60

    Polar Surface Area:
    161.86

    HBA:
    14

    HBD:
    3

    #RO5 Violations:
    3

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  2. ALA2289351

    Name:
    2,6-dimethyl-N-(4-(4-nitrophenoxy)benzyl)-2,4,5,6-
    Show More

    Mol. Formula:
    C22H22N4O4

    M.W.:
    406.44

    Type:
    Small molecule

    AlogP:
    4.10

    Polar Surface Area:
    99.29

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  3. ALA2289193

    Name:
    2,2,2-Trifluoroethyl 4-(3-(2,6-Difluorobenzoyl)ure
    Show More

    Mol. Formula:
    C16H11F5N2O5S

    M.W.:
    438.33

    Type:
    Small molecule

    AlogP:
    3.19

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  4. ALA2289192

    Name:
    2-Isopropyl-5-methylcyclohexyl 4-(3-(2,6-Difluorob
    Show More

    Mol. Formula:
    C24H28F2N2O5S

    M.W.:
    494.56

    Type:
    Small molecule

    AlogP:
    5.09

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  5. ALA2289191

    Name:
    4-Chlorophenyl 4-(3-(2,6-Difluorobenzoyl)ureido)-b
    Show More

    Mol. Formula:
    C20H13ClF2N2O5S

    M.W.:
    466.85

    Type:
    Small molecule

    AlogP:
    4.35

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  6. ALA2289190

    Name:
    N-(4-(4-tert-Butylbenzylcarbamoyl)phenylcarbamoyl)
    Show More

    Mol. Formula:
    C26H25F2N3O3

    M.W.:
    465.50

    Type:
    Small molecule

    AlogP:
    5.15

    Polar Surface Area:
    87.30

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  7. ALA2289189

    Name:
    2,6-Difluoro-N-(4-(morpholine-4-carbonyl)-phenylca
    Show More

    Mol. Formula:
    C19H17F2N3O4

    M.W.:
    389.36

    Type:
    Small molecule

    AlogP:
    2.40

    Polar Surface Area:
    87.74

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  8. ALA2289188

    Name:
    N-(4-(Butylcarbamoyl)phenylcarbamoyl)-2,6-difluoro
    Show More

    Mol. Formula:
    C19H19F2N3O3

    M.W.:
    375.38

    Type:
    Small molecule

    AlogP:
    3.46

    Polar Surface Area:
    87.30

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  9. ALA2288964

    Name:
    N-(4-(4-Chlorophenylcarbamoyl)phenylcarbamoyl)-2,6
    Show More

    Mol. Formula:
    C21H14ClF2N3O3

    M.W.:
    429.81

    Type:
    Small molecule

    AlogP:
    4.83

    Polar Surface Area:
    87.30

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  10. ALA2288963

    Name:
    N-(4-((4-Chlorophenyl)(methyl)carbamoyl)-phenylcar
    Show More

    Mol. Formula:
    C22H16ClF2N3O3

    M.W.:
    443.84

    Type:
    Small molecule

    AlogP:
    4.86

    Polar Surface Area:
    78.51

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  11. ALA2288962

    Name:
    N-(4-(Diisopropylcarbamoyl)phenylcarbamoyl)-2,6-di
    Show More

    Mol. Formula:
    C21H23F2N3O3

    M.W.:
    403.43

    Type:
    Small molecule

    AlogP:
    4.19

    Polar Surface Area:
    78.51

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  12. ALA2288961

    Name:
    N-(4-(tert-Butylcarbamoyl)phenylcarbamoyl)-2,6-dif
    Show More

    Mol. Formula:
    C19H19F2N3O3

    M.W.:
    375.38

    Type:
    Small molecule

    AlogP:
    3.46

    Polar Surface Area:
    87.30

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  13. ALA2288960

    Name:
    Pentyl 4-(3-(2,6-Difluorobenzoyl)ureido)-benzenesu
    Show More

    Mol. Formula:
    C19H20F2N2O5S

    M.W.:
    426.44

    Type:
    Small molecule

    AlogP:
    3.82

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  14. ALA2288959

    Name:
    4-Chlorobutyl 4-(3-(2,6-Difluorobenzoyl)ureido)-be
    Show More

    Mol. Formula:
    C18H17ClF2N2O5S

    M.W.:
    446.86

    Type:
    Small molecule

    AlogP:
    3.65

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  15. ALA2288958

    Name:
    1,1,1,3,3,3-Hexafluoropropan-2-yl 4-(3-(2,6-Difluo
    Show More

    Mol. Formula:
    C17H10F8N2O5S

    M.W.:
    506.33

    Type:
    Small molecule

    AlogP:
    4.13

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  16. ALA2288957

    Name:
    2-Chloroethyl 4-(3-(2,6-Difluorobenzoyl)ureido)-be
    Show More

    Mol. Formula:
    C16H13ClF2N2O5S

    M.W.:
    418.81

    Type:
    Small molecule

    AlogP:
    2.87

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  17. ALA2288956

    Name:
    2-Fluoroethyl 4-(3-(2,6-Difluorobenzoyl)ureido)-be
    Show More

    Mol. Formula:
    C16H13F3N2O5S

    M.W.:
    402.35

    Type:
    Small molecule

    AlogP:
    2.60

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  18. ALA2288634

    Name:
    3-(3-(2,6-dichloro-4-(3,3-dichloroallyloxy)phenoxy
    Show More

    Mol. Formula:
    C24H24Cl4N2O3

    M.W.:
    530.28

    Type:
    Small molecule

    AlogP:
    7.56

    Polar Surface Area:
    45.51

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  19. ALA2288633

    Name:
    3-(3-(2,6-dichloro-4-(3,3-dichloroallyloxy)phenoxy
    Show More

    Mol. Formula:
    C23H22Cl4N2O3

    M.W.:
    516.25

    Type:
    Small molecule

    AlogP:
    7.25

    Polar Surface Area:
    45.51

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  20. ALA2288632

    Name:
    3-(3-(2,6-dichloro-4-(3,3-dichloroallyloxy)phenoxy
    Show More

    Mol. Formula:
    C22H20Cl4N2O3

    M.W.:
    502.23

    Type:
    Small molecule

    AlogP:
    6.94

    Polar Surface Area:
    45.51

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
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