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  1. ALA1089480

    Name:
    1-(5-(dimethylamino)-2-(furan-2-yl)-[1,2,4]triazol
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    Mol. Formula:
    C18H18N8O2

    M.W.:
    378.40

    Type:
    Small molecule

    AlogP:
    2.80

    Polar Surface Area:
    113.48

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  2. ALA1089799

    Name:
    1-(5-(dimethylamino)-2-(furan-2-yl)-[1,2,4]triazol
    Show More

    Mol. Formula:
    C17H16N8O2

    M.W.:
    364.37

    Type:
    Small molecule

    AlogP:
    2.49

    Polar Surface Area:
    113.48

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  3. ALA1089798

    Name:
    5-Dimethylamino-2-(2-furyl)-7-n-pentylcarbonylamin
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    Mol. Formula:
    C16H21N7O2

    M.W.:
    343.39

    Type:
    Small molecule

    AlogP:
    2.36

    Polar Surface Area:
    101.45

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  4. ALA1089463

    Name:
    5-Dimethylamino-2-(2-furyl)-7-[4-(methoxyphenyl)-a
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    Mol. Formula:
    C19H19N7O3

    M.W.:
    393.41

    Type:
    Small molecule

    AlogP:
    2.04

    Polar Surface Area:
    110.68

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  5. ALA1089113

    Name:
    5-Dimethylamino-2-(2-furyl)-7-phenylacetylamino-[1
    Show More

    Mol. Formula:
    C18H17N7O2

    M.W.:
    363.38

    Type:
    Small molecule

    AlogP:
    2.03

    Polar Surface Area:
    101.45

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  6. ALA1089112

    Name:
    5-Dimethylamino-7-diphenylacetylamino-2-(2-furyl)-
    Show More

    Mol. Formula:
    C24H21N7O2

    M.W.:
    439.48

    Type:
    Small molecule

    AlogP:
    3.62

    Polar Surface Area:
    101.45

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  7. ALA1089441

    Name:
    1-(2-(furan-2-yl)-5-phenoxy-[1,2,4]triazolo[1,5-a]
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    Mol. Formula:
    C22H17N7O3

    M.W.:
    427.42

    Type:
    Small molecule

    AlogP:
    4.52

    Polar Surface Area:
    119.47

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  8. ALA1089440

    Name:
    N-(2-(furan-2-yl)-5-phenoxy-[1,2,4]triazolo[1,5-a]
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    Mol. Formula:
    C21H15N7O3

    M.W.:
    413.40

    Type:
    Small molecule

    AlogP:
    4.22

    Polar Surface Area:
    119.47

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  9. ALA1089439

    Name:
    2-(2-Furyl)-7-n-pentylcarbonylamino-5-phenoxy[1,2,
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    Mol. Formula:
    C20H20N6O3

    M.W.:
    392.42

    Type:
    Small molecule

    AlogP:
    4.09

    Polar Surface Area:
    107.44

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  10. ALA1089438

    Name:
    2-(2-Furyl)-7-[4-(methoxyphenyl)acetyl]amino-5-phe
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    Mol. Formula:
    C23H18N6O4

    M.W.:
    442.44

    Type:
    Small molecule

    AlogP:
    3.76

    Polar Surface Area:
    116.67

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  11. ALA1088770

    Name:
    2-(2-Furyl)-5-phenoxy 7-phenylacetylamino-[1,2,4]t
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    Mol. Formula:
    C22H16N6O3

    M.W.:
    412.41

    Type:
    Small molecule

    AlogP:
    3.75

    Polar Surface Area:
    107.44

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  12. ALA1092870

    Name:
    7-Diphenylacetylamino-2-(2-furyl)-5-phenoxy[1,2,4]
    Show More

    Mol. Formula:
    C28H20N6O3

    M.W.:
    488.51

    Type:
    Small molecule

    AlogP:
    5.34

    Polar Surface Area:
    107.44

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  13. ALA1092869

    Name:
    1-(2-(furan-2-yl)-5-(methylthio)-[1,2,4]triazolo[1
    Show More

    Mol. Formula:
    C17H15N7O2S

    M.W.:
    381.42

    Type:
    Small molecule

    AlogP:
    3.45

    Polar Surface Area:
    110.24

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  14. ALA1092868

    Name:
    1-(2-(furan-2-yl)-5-(methylthio)-[1,2,4]triazolo[1
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    Mol. Formula:
    C16H13N7O2S

    M.W.:
    367.39

    Type:
    Small molecule

    AlogP:
    3.15

    Polar Surface Area:
    110.24

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  15. ALA1092579

    Name:
    2-(2-Furyl)-5-methylthio-7-n-pentylcarbonylamino-[
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    Mol. Formula:
    C15H18N6O2S

    M.W.:
    346.42

    Type:
    Small molecule

    AlogP:
    3.02

    Polar Surface Area:
    98.21

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  16. ALA1090806

    Name:
    2-(2-Furyl)-7-[4-(methoxyphenyl)acetyl]amino-5-met
    Show More

    Mol. Formula:
    C18H16N6O3S

    M.W.:
    396.43

    Type:
    Small molecule

    AlogP:
    2.69

    Polar Surface Area:
    107.44

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  17. ALA1090126

    Name:
    2-(2-Furyl)-5-methylthio-7-phenylacetylamino[1,2,4
    Show More

    Mol. Formula:
    C17H14N6O2S

    M.W.:
    366.41

    Type:
    Small molecule

    AlogP:
    2.68

    Polar Surface Area:
    98.21

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  18. ALA1090125

    Name:
    7-Diphenyl-acetylamino-2-(2-furyl)-5-methylthio[1,
    Show More

    Mol. Formula:
    C23H18N6O2S

    M.W.:
    442.50

    Type:
    Small molecule

    AlogP:
    4.27

    Polar Surface Area:
    98.21

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  19. ALA1090124

    Name:
    7-Amino-5-dimethylammino-2-(2-furyl)-[1,2,4]triazo
    Show More

    Mol. Formula:
    C10H11N7O

    M.W.:
    245.25

    Type:
    Small molecule

    AlogP:
    0.43

    Polar Surface Area:
    98.37

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  20. ALA1090123

    Name:
    2-(furan-2-yl)-5-(methylthio)-[1,2,4]triazolo[1,5-
    Show More

    Cas Number:
    139181-27-4

    Mol. Formula:
    C9H8N6OS

    M.W.:
    248.27

    Type:
    Small molecule

    AlogP:
    1.08

    Polar Surface Area:
    95.13

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
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