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  1. ALA4546520

    Name:
    N-[4-(Diethylamino)phenyl]-5-methyl-4-phenylthioph
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    Mol. Formula:
    C22H24N2OS

    M.W.:
    364.51

    Type:
    Unknown

    AlogP:
    5.82

    Polar Surface Area:
    32.34

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  2. ALA4550877

    Name:
    3-(4-Cyanophenyl)-1-[4-(diethylamino)benzyl]-1-(5-
    Show More

    Mol. Formula:
    C29H29N5O2

    M.W.:
    479.58

    Type:
    Unknown

    AlogP:
    6.61

    Polar Surface Area:
    85.40

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  3. ALA4556312

    Name:
    4-(N,5-Dimethyl-3-phenylisoxazole-4-carboxamido)be
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    Mol. Formula:
    C19H16N2O4

    M.W.:
    336.35

    Type:
    Unknown

    AlogP:
    3.62

    Polar Surface Area:
    83.64

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  4. ALA4559136

    Name:
    N-[4-[Ethyl(isopropyl)amino]phenyl]-3-methyl-5-phe
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    Mol. Formula:
    C22H25N3O2

    M.W.:
    363.46

    Type:
    Unknown

    AlogP:
    5.14

    Polar Surface Area:
    58.37

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  5. ALA4558107

    Name:
    N-[4-(Diethylamino)phenyl]-N,5-dimethyl-3-phenylis
    Show More

    Mol. Formula:
    C22H25N3OS

    M.W.:
    379.53

    Type:
    Unknown

    AlogP:
    5.31

    Polar Surface Area:
    32.51

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  6. ALA4555416

    Name:
    N-[4-(Diethylamino)phenyl]-5-methyl-3-phenylisoxaz
    Show More

    Mol. Formula:
    C21H23N3OS

    M.W.:
    365.50

    Type:
    Unknown

    AlogP:
    5.28

    Polar Surface Area:
    41.30

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  7. ALA4552264

    Name:
    N-(3-Hydroxypropyl)-N-methyl-4-[(5-methyl-3-phenyl
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    Mol. Formula:
    C22H24N2O4

    M.W.:
    380.44

    Type:
    Unknown

    AlogP:
    3.68

    Polar Surface Area:
    75.80

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  8. ALA4552000

    Name:
    2-Cyanoethyl 4-[(5-Methyl-3-phenylisoxazol-4-yl)me
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    Mol. Formula:
    C21H18N2O4

    M.W.:
    362.39

    Type:
    Unknown

    AlogP:
    4.30

    Polar Surface Area:
    85.35

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  9. ALA4551852

    Name:
    N-[4-(Dimethylamino)phenyl]-5-methyl-3-(3-nitrophe
    Show More

    Mol. Formula:
    C19H18N4O4

    M.W.:
    366.38

    Type:
    Unknown

    AlogP:
    3.88

    Polar Surface Area:
    101.51

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  10. ALA4538691

    Name:
    2-Oxopropyl 4-[(5-methyl-3-phenylisoxazol-4-yl)met
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    Mol. Formula:
    C21H19NO5

    M.W.:
    365.39

    Type:
    Unknown

    AlogP:
    3.97

    Polar Surface Area:
    78.63

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  11. ALA4538433

    Name:
    N-[4-(tert-Butyl)thiazol-2-yl]-5-methyl-3-phenylis
    Show More

    Mol. Formula:
    C18H19N3O2S

    M.W.:
    341.44

    Type:
    Unknown

    AlogP:
    4.66

    Polar Surface Area:
    68.02

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  12. ALA4537362

    Name:
    N-[4-(Diethylamino)phenyl]-5-methyl-3-(thiophen-3-
    Show More

    Mol. Formula:
    C19H21N3O2S

    M.W.:
    355.46

    Type:
    Unknown

    AlogP:
    4.81

    Polar Surface Area:
    58.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  13. ALA4537081

    Name:
    N-[4-(Diethylamino)phenyl]-5-phenyloxazole-4-carbo
    Show More

    Mol. Formula:
    C20H21N3O2

    M.W.:
    335.41

    Type:
    Unknown

    AlogP:
    4.44

    Polar Surface Area:
    58.37

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  14. ALA4536598

    Name:
    N-[4-(Diethylamino)phenyl]-3-[4'-fluoro-[1,1'-biph
    Show More

    Mol. Formula:
    C27H26FN3O2

    M.W.:
    443.52

    Type:
    Unknown

    AlogP:
    6.55

    Polar Surface Area:
    58.37

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  15. ALA4534185

    Name:
    N,N-Diethyl-4-[(5-methyl-3-phenylisoxazol-4-yl)met
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    Mol. Formula:
    C22H24N2O3

    M.W.:
    364.45

    Type:
    Unknown

    AlogP:
    4.71

    Polar Surface Area:
    55.57

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  16. ALA4533999

    Name:
    N-[4-(Diethylamino)phenyl]-5-(furan-2-yl)oxazole-4
    Show More

    Mol. Formula:
    C18H19N3O3

    M.W.:
    325.37

    Type:
    Unknown

    AlogP:
    4.03

    Polar Surface Area:
    71.51

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  17. ALA4532293

    Name:
    E/Z-2-Fluoroethyl N-[4-(diethylamino)phenyl]-5-met
    Show More

    Mol. Formula:
    C23H26FN3OS

    M.W.:
    411.55

    Type:
    Unknown

    AlogP:
    6.28

    Polar Surface Area:
    41.63

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  18. ALA4532283

    Name:
    N-[4-(diethylamino)phenyl]thiophene-3-carboxamide

    Mol. Formula:
    C15H18N2OS

    M.W.:
    274.39

    Type:
    Unknown

    AlogP:
    3.85

    Polar Surface Area:
    32.34

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.90

    DETAILS
  19. ALA4092074

    Name:
    5-methyl-N-(4-(1-methyl-1H-imidazol-2-ylthio)pheny
    Show More

    Mol. Formula:
    C21H18N4O2S

    M.W.:
    390.47

    Type:
    Small molecule

    AlogP:
    4.79

    Polar Surface Area:
    72.95

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  20. ALA4091690

    Name:
    5-methyl-N-(4-phenoxyphenyl)-3-phenylisoxazole-4-c
    Show More

    Cas Number:
    438472-70-9

    Mol. Formula:
    C23H18N2O3

    M.W.:
    370.41

    Type:
    Small molecule

    AlogP:
    5.69

    Polar Surface Area:
    64.36

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
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