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  1. ALA5094079

    Name:
    5-(hex-1-ynyl)-2-(tetrahydrofuran-3-ylamino)benzam
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    Mol. Formula:
    C17H22N2O2

    M.W.:
    286.38

    Type:
    Unknown

    AlogP:
    2.53

    Polar Surface Area:
    64.35

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  2. ALA5093787

    Name:
    5-(3,3-dimethylbut-1-ynyl)-2-((1r,4r)-4-hydroxycyc
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    Mol. Formula:
    C19H26N2O2

    M.W.:
    314.43

    Type:
    Unknown

    AlogP:
    2.90

    Polar Surface Area:
    75.35

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  3. ALA5093243

    Name:
    5-(hex-1-ynyl)-2-((1r,4r)-4-hydroxycyclohexylamino
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    Mol. Formula:
    C19H26N2O2

    M.W.:
    314.43

    Type:
    Unknown

    AlogP:
    3.04

    Polar Surface Area:
    75.35

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  4. ALA5093202

    Name:
    5-(hex-1-ynyl)-2-(1-(2-morpholinoacetyl)piperidin-
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    Mol. Formula:
    C24H34N4O3

    M.W.:
    426.56

    Type:
    Unknown

    AlogP:
    2.06

    Polar Surface Area:
    87.90

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  5. ALA5092629

    Name:
    2-(1-acetylpiperidin-3-ylamino)-5-(hex-1-ynyl)benz
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    Mol. Formula:
    C20H27N3O2

    M.W.:
    341.46

    Type:
    Unknown

    AlogP:
    2.75

    Polar Surface Area:
    75.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  6. ALA5092143

    Name:
    5-(3-(diethylamino)prop-1-ynyl)-2-((1r,4r)-4-hydro
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    Mol. Formula:
    C20H29N3O2

    M.W.:
    343.47

    Type:
    Unknown

    AlogP:
    2.19

    Polar Surface Area:
    78.59

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  7. ALA5091953

    Name:
    5-(3-(dimethylamino)prop-1-ynyl)-2-((1r,4r)-4-hydr
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    Mol. Formula:
    C18H25N3O2

    M.W.:
    315.42

    Type:
    Unknown

    AlogP:
    1.41

    Polar Surface Area:
    78.59

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  8. ALA5091405

    Name:
    2-(1-(2-cyclopropylacetyl)piperidin-4-ylamino)-5-(
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    Mol. Formula:
    C23H31N3O2

    M.W.:
    381.52

    Type:
    Unknown

    AlogP:
    3.53

    Polar Surface Area:
    75.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  9. ALA5090818

    Name:
    5-(hex-1-ynyl)-2-((tetrahydro-2H-pyran-4-yl)methyl
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    Mol. Formula:
    C19H26N2O2

    M.W.:
    314.43

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    64.35

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  10. ALA5090524

    Name:
    5-(hex-1-ynyl)-2-(1-(3-morpholinopropanoyl)piperid
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    Mol. Formula:
    C25H36N4O3

    M.W.:
    440.59

    Type:
    Unknown

    AlogP:
    2.45

    Polar Surface Area:
    87.90

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  11. ALA5090316

    Name:
    5-(cyclohexylethynyl)-2-((1r,4r)-4-hydroxycyclohex
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    Mol. Formula:
    C21H28N2O2

    M.W.:
    340.47

    Type:
    Unknown

    AlogP:
    3.43

    Polar Surface Area:
    75.35

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  12. ALA5089381

    Name:
    5-(hex-1-ynyl)-2-(tetrahydro-2H-pyran-4-ylamino)be
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    Mol. Formula:
    C18H24N2O2

    M.W.:
    300.40

    Type:
    Unknown

    AlogP:
    2.92

    Polar Surface Area:
    64.35

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  13. ALA5089184

    Name:
    5-(hex-1-ynyl)-2-(3-methoxypropylamino)benzamide

    Mol. Formula:
    C17H24N2O2

    M.W.:
    288.39

    Type:
    Unknown

    AlogP:
    2.78

    Polar Surface Area:
    64.35

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  14. ALA5089044

    Name:
    5-(cyclopentylethynyl)-2-((1r,4r)-4-hydroxycyclohe
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    Mol. Formula:
    C20H26N2O2

    M.W.:
    326.44

    Type:
    Unknown

    AlogP:
    3.04

    Polar Surface Area:
    75.35

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  15. ALA5089014

    Name:
    2-(3-ethoxypropylamino)-5-(hex-1-ynyl)benzamide

    Mol. Formula:
    C18H26N2O2

    M.W.:
    302.42

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    64.35

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  16. ALA5088257

    Name:
    5-(hex-1-ynyl)-2-(piperidin-4-ylamino)benzamide

    Mol. Formula:
    C18H25N3O

    M.W.:
    299.42

    Type:
    Unknown

    AlogP:
    2.49

    Polar Surface Area:
    67.15

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  17. ALA5088079

    Name:
    5-(hex-1-ynyl)-2-(piperidin-4-ylmethylamino)benzam
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    Mol. Formula:
    C19H27N3O

    M.W.:
    313.45

    Type:
    Unknown

    AlogP:
    2.74

    Polar Surface Area:
    67.15

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  18. ALA5087889

    Name:
    2-((1r,4r)-4-hydroxycyclohexylamino)-5-(5-methylhe
    Show More

    Mol. Formula:
    C20H28N2O2

    M.W.:
    328.46

    Type:
    Unknown

    AlogP:
    3.29

    Polar Surface Area:
    75.35

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  19. ALA5087678

    Name:
    2-((1r,4r)-4-hydroxycyclohexylamino)-5-(4-methylpe
    Show More

    Mol. Formula:
    C19H26N2O2

    M.W.:
    314.43

    Type:
    Unknown

    AlogP:
    2.90

    Polar Surface Area:
    75.35

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  20. ALA5087473

    Name:
    2-(2-acetamidoethylamino)-5-(hex-1-ynyl)benzamide

    Mol. Formula:
    C17H23N3O2

    M.W.:
    301.39

    Type:
    Unknown

    AlogP:
    1.88

    Polar Surface Area:
    84.22

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
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