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  1. ALA5093194

    Name:
    3-(benzyl(3-(phenylthio)benzyl)amino)propanoic aci
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    Mol. Formula:
    C23H23NO2S

    M.W.:
    377.51

    Type:
    Unknown

    AlogP:
    5.31

    Polar Surface Area:
    40.54

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  2. ALA5093170

    Name:
    (6-chlorothiazolo[5,4-b]pyridin-2-yl)methanol

    Mol. Formula:
    C7H5ClN2OS

    M.W.:
    200.65

    Type:
    Unknown

    AlogP:
    1.84

    Polar Surface Area:
    46.01

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  3. ALA5092442

    Name:
    3-[(3-Chlorobenzyl)oxy]-2,6-difluorobenzamide

    Mol. Formula:
    C14H10ClF2NO2

    M.W.:
    297.69

    Type:
    Unknown

    AlogP:
    3.30

    Polar Surface Area:
    52.32

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.94

    DETAILS
  4. ALA5092407

    Name:
    2,6-difluoro-3-((1-((7-nitrobenzo[c][1,2,5]oxadiaz
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    Mol. Formula:
    C18H17F2N5O5

    M.W.:
    421.36

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    146.41

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  5. ALA5092196

    Name:
    3-(3-chlorophenethoxy)benzamide

    Mol. Formula:
    C15H14ClNO2

    M.W.:
    275.74

    Type:
    Unknown

    AlogP:
    3.06

    Polar Surface Area:
    52.32

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.91

    DETAILS
  6. ALA5091931

    Name:
    2,6-difluoro-3-((1-((7-nitrobenzo[c][1,2,5]oxadiaz
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    Mol. Formula:
    C20H21F2N5O5

    M.W.:
    449.41

    Type:
    Unknown

    AlogP:
    3.95

    Polar Surface Area:
    146.41

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  7. ALA5091172

    Name:
    3-{3-(Dimethylamino)-1-[3-(trifluoromethyl)phenyl]
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    Mol. Formula:
    C19H19F5N2O2

    M.W.:
    402.36

    Type:
    Unknown

    AlogP:
    4.15

    Polar Surface Area:
    55.56

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  8. ALA5091006

    Name:
    2,6-difluoro-3-((2-((7-nitrobenzo[c][1,2,5]oxadiaz
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    Mol. Formula:
    C18H17F2N5O5

    M.W.:
    421.36

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    146.41

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  9. ALA5090793

    Name:
    (S)-2,6-difluoro-3-((1-((7-nitrobenzo[c][1,2,5]oxa
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    Mol. Formula:
    C18H17F2N5O5

    M.W.:
    421.36

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    146.41

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  10. ALA5090219

    Name:
    2,6-Difluoro-3-{2-[3-(trifluoromethyl)phenyl]ethox
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    Mol. Formula:
    C16H12F5NO2

    M.W.:
    345.27

    Type:
    Unknown

    AlogP:
    3.70

    Polar Surface Area:
    52.32

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  11. ALA5089927

    Name:
    (S)-2,6-Difluoro-3-[(2-{[3-(trifluoromethyl)phenyl
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    Mol. Formula:
    C19H19F5N2O2

    M.W.:
    402.36

    Type:
    Unknown

    AlogP:
    4.74

    Polar Surface Area:
    64.35

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  12. ALA5088380

    Name:
    4-((3,5-dihydroxybenzoyl)oxy)naphthalen-2-yl 3,4-d
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    Mol. Formula:
    C24H16O8

    M.W.:
    432.38

    Type:
    Unknown

    AlogP:
    4.10

    Polar Surface Area:
    133.52

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  13. ALA5087202

    Name:
    2,6-difluoro-3-((1-((7-nitrobenzo[c][1,2,5]oxadiaz
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    Mol. Formula:
    C23H27F2N5O5

    M.W.:
    491.50

    Type:
    Unknown

    AlogP:
    5.12

    Polar Surface Area:
    146.41

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  14. ALA5086390

    Name:
    3-((3-chlorobenzyl)amino)benzamide

    Mol. Formula:
    C14H13ClN2O

    M.W.:
    260.72

    Type:
    Unknown

    AlogP:
    3.05

    Polar Surface Area:
    55.12

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.89

    DETAILS
  15. ALA5085966

    Name:
    2,6-Difluoro-3-{3-[3-(trifluoromethyl)phenyl]propo
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    Mol. Formula:
    C17H14F5NO2

    M.W.:
    359.29

    Type:
    Unknown

    AlogP:
    4.09

    Polar Surface Area:
    52.32

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  16. ALA5085404

    Name:
    (R)-2,6-Difluoro-3-[(2-{[3-(trifluoromethyl)phenyl
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    Mol. Formula:
    C19H19F5N2O2

    M.W.:
    402.36

    Type:
    Unknown

    AlogP:
    4.74

    Polar Surface Area:
    64.35

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  17. ALA5084076

    Name:
    2,6-difluoro-3-(2-((7-nitrobenzo[c][1,2,5]oxadiazo
    Show More

    Mol. Formula:
    C15H11F2N5O5

    M.W.:
    379.28

    Type:
    Unknown

    AlogP:
    2.00

    Polar Surface Area:
    146.41

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  18. ALA5081697

    Name:
    2,6-Difluoro-3-{[4-(trifluoromethyl)benzyl]oxy}ben
    Show More

    Mol. Formula:
    C15H10F5NO2

    M.W.:
    331.24

    Type:
    Unknown

    AlogP:
    3.66

    Polar Surface Area:
    52.32

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  19. ALA5081559

    Name:
    (R)-2,6-difluoro-3-((2-((7-nitrobenzo[c][1,2,5]oxa
    Show More

    Mol. Formula:
    C18H17F2N5O5

    M.W.:
    421.36

    Type:
    Unknown

    AlogP:
    3.17

    Polar Surface Area:
    146.41

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  20. ALA5080731

    Name:
    2,6-Difluoro-3-{[3-(trifluoromethyl)benzyl]oxy}ben
    Show More

    Mol. Formula:
    C15H10F5NO2

    M.W.:
    331.24

    Type:
    Unknown

    AlogP:
    3.66

    Polar Surface Area:
    52.32

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
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