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  1. ALA5286195

    Name:
    di-tert-butyl 4,4'-(2,2'-(azanediylbis(ethane-2,1-
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    Mol. Formula:
    C46H51N9O12

    M.W.:
    921.96

    Type:
    ---

    AlogP:
    5.41

    Polar Surface Area:
    238.63

    HBA:
    15

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  2. ALA5284203

    Name:
    2,2'-(azanediylbis(ethane-2,1-diyl))bis(5-nitro-6-
    Show More

    Mol. Formula:
    C38H37N7O8

    M.W.:
    719.75

    Type:
    ---

    AlogP:
    5.27

    Polar Surface Area:
    179.55

    HBA:
    11

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  3. ALA5280600

    Name:
    2,2'-(azanediylbis(ethane-2,1-diyl))bis(6-([1,4'-b
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    Mol. Formula:
    C48H55N9O8

    M.W.:
    886.02

    Type:
    ---

    AlogP:
    6.20

    Polar Surface Area:
    186.03

    HBA:
    13

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  4. ALA5280001

    Name:
    2-(2-(benzo[d][1,3]dioxol-5-yl)ethyl)-6-morpholino
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    Mol. Formula:
    C25H21N3O7

    M.W.:
    475.46

    Type:
    ---

    AlogP:
    3.15

    Polar Surface Area:
    111.45

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  5. ALA5288807

    Name:
    (4'S,6a'R,6b'S,8a'S,13a'S,13b'R)-9'-cyano-1-(2,6-d
    Show More

    Mol. Formula:
    C39H39F2N3O4

    M.W.:
    651.75

    Type:
    ---

    AlogP:
    7.66

    Polar Surface Area:
    103.48

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  6. ALA4791303

    Name:
    (E)-6-Chloro-2-(3,4-dimethoxystyryl)-4-[2-(morphol
    Show More

    Mol. Formula:
    C24H27ClN4O3

    M.W.:
    454.96

    Type:
    Unknown

    AlogP:
    4.21

    Polar Surface Area:
    68.74

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  7. ALA4757196

    Name:
    (E)-2-(3,4-dimethoxystyryl)-4-(1-piperidinylethyl)
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    Mol. Formula:
    C25H30N4O2

    M.W.:
    418.54

    Type:
    Unknown

    AlogP:
    4.72

    Polar Surface Area:
    59.51

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  8. ALA4756911

    Name:
    (E)-6-Chloro-2-(4-nitrostyryl)-4-(2-dimethylaminoe
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    Mol. Formula:
    C20H20ClN5O2

    M.W.:
    397.87

    Type:
    Unknown

    AlogP:
    4.34

    Polar Surface Area:
    84.19

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  9. ALA4756696

    Name:
    (E)-2-(3,4-Methylenedioxystyryl)-4[2-(morpholinyl)
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    Mol. Formula:
    C23H24N4O3

    M.W.:
    404.47

    Type:
    Unknown

    AlogP:
    3.27

    Polar Surface Area:
    68.74

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  10. ALA4776273

    Name:
    (E)-2-(4-Nitrostyryl)-4-(1-piperidinylethyl)aminoq
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    Mol. Formula:
    C23H25N5O2

    M.W.:
    403.49

    Type:
    Unknown

    AlogP:
    4.61

    Polar Surface Area:
    84.19

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  11. ALA4764913

    Name:
    (E)-6-Chloro-2-(4-nitrostyryl)-4-(1-piperidinyleth
    Show More

    Mol. Formula:
    C23H24ClN5O2

    M.W.:
    437.93

    Type:
    Unknown

    AlogP:
    5.26

    Polar Surface Area:
    84.19

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  12. ALA5277147

    Name:
    (4'S,6a'R,6b'S,8a'S,13a'S,13b'R)-9'-cyano-10'-imin
    Show More

    Mol. Formula:
    C40H43N3O4

    M.W.:
    629.80

    Type:
    ---

    AlogP:
    7.69

    Polar Surface Area:
    103.48

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  13. ALA5276557

    Name:
    2,2'-(azanediylbis(ethane-2,1-diyl))bis(5-nitro-1H
    Show More

    Mol. Formula:
    C28H19N5O8

    M.W.:
    553.49

    Type:
    ---

    AlogP:
    3.29

    Polar Surface Area:
    173.07

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
  14. ALA5275285

    Name:
    2,2'-(azanediylbis(ethane-2,1-diyl))bis(6-morpholi
    Show More

    Mol. Formula:
    C36H33N7O10

    M.W.:
    723.70

    Type:
    ---

    AlogP:
    2.96

    Polar Surface Area:
    198.01

    HBA:
    13

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  15. ALA5274199

    Name:
    2,2'-(azanediylbis(ethane-2,1-diyl))bis(6-(4-methy
    Show More

    Mol. Formula:
    C38H39N9O8

    M.W.:
    749.78

    Type:
    ---

    AlogP:
    2.79

    Polar Surface Area:
    186.03

    HBA:
    13

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  16. ALA5271947

    Name:
    2-(2-(dimethylamino)ethyl)-6-morpholino-5-nitro-1H
    Show More

    Mol. Formula:
    C20H22N4O5

    M.W.:
    398.42

    Type:
    ---

    AlogP:
    1.74

    Polar Surface Area:
    96.23

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  17. ALA5269853

    Name:
    2-(2-hydroxyethyl)-6-morpholino-5-nitro-1H-benzo[d
    Show More

    Mol. Formula:
    C18H17N3O6

    M.W.:
    371.35

    Type:
    ---

    AlogP:
    1.17

    Polar Surface Area:
    113.22

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  18. ALA5207285

    Name:
    (E)-2-(3,3,3-Trifluoro-1-(phenylsulfonyl)prop-1-en
    Show More

    Mol. Formula:
    C14H10F3NO2S

    M.W.:
    313.30

    Type:
    ---

    AlogP:
    3.46

    Polar Surface Area:
    47.03

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  19. ALA5205285

    Name:
    3-Nitro-7H-dibenzo[de,g]quinolin-7-one

    Mol. Formula:
    C16H8N2O3

    M.W.:
    276.25

    Type:
    ---

    AlogP:
    3.35

    Polar Surface Area:
    73.10

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  20. ALA5201698

    Name:
    (E)-1-(4-(3,3,3-Trifluoro-1-((4-fluorophenyl)sulfo
    Show More

    Mol. Formula:
    C17H12F4O3S

    M.W.:
    372.34

    Type:
    ---

    AlogP:
    4.41

    Polar Surface Area:
    51.21

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
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