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  1. ALA5178572

    Name:
    3-(1-methyl-9H-pyrido[3,4-b]indol-3-yl)acrylic aci
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    Mol. Formula:
    C15H12N2O2

    M.W.:
    252.27

    Type:
    ---

    AlogP:
    3.12

    Polar Surface Area:
    65.98

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  2. ALA2251529

    Name:
    (E)-methyl 2-(2-(((1,3-dimethyl-5-(2,2,2-trifluoro
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    Mol. Formula:
    C19H21F3N4O5

    M.W.:
    442.39

    Type:
    Small molecule

    AlogP:
    2.74

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  3. ALA2251528

    Name:
    (E)-methyl 2-(2-(((1,3-dimethyl-5-propoxy-1H-pyraz
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    Mol. Formula:
    C20H26N4O5

    M.W.:
    402.45

    Type:
    Small molecule

    AlogP:
    2.59

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  4. ALA2251527

    Name:
    (E)-methyl 2-(2-(((5-ethoxy-1,3-dimethyl-1H-pyrazo
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    Mol. Formula:
    C19H24N4O5

    M.W.:
    388.42

    Type:
    Small molecule

    AlogP:
    2.20

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  5. ALA2251526

    Name:
    (E)-methyl 2-(2-(((5-methoxy-1,3-dimethyl-1H-pyraz
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    Mol. Formula:
    C18H22N4O5

    M.W.:
    374.40

    Type:
    Small molecule

    AlogP:
    1.81

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  6. ALA2251525

    Name:
    (E)-methyl 2-(2-(((1,3-dimethyl-5-(3-(trifluoromet
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    Mol. Formula:
    C24H23F3N4O5

    M.W.:
    504.47

    Type:
    Small molecule

    AlogP:
    4.61

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  7. ALA2251524

    Name:
    (E)-methyl 2-(2-(((5-(4-fluorophenoxy)-1,3-dimethy
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    Mol. Formula:
    C23H23FN4O5

    M.W.:
    454.46

    Type:
    Small molecule

    AlogP:
    3.73

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  8. ALA2251523

    Name:
    (E)-methyl 2-(2-(((5-(2-fluorophenoxy)-1,3-dimethy
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    Mol. Formula:
    C23H23FN4O5

    M.W.:
    454.46

    Type:
    Small molecule

    AlogP:
    3.73

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  9. ALA2251522

    Name:
    (E)-methyl 2-(2-(((1,3-dimethyl-5-(3-nitrophenoxy)
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    Mol. Formula:
    C23H23N5O7

    M.W.:
    481.47

    Type:
    Small molecule

    AlogP:
    3.50

    Polar Surface Area:
    139.67

    HBA:
    11

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  10. ALA2251521

    Name:
    (E)-methyl 2-(2-(((5-(2,4-dichlorophenoxy)-1,3-dim
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    Mol. Formula:
    C23H22Cl2N4O5

    M.W.:
    505.36

    Type:
    Small molecule

    AlogP:
    4.90

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  11. ALA2251520

    Name:
    (E)-methyl 2-(2-(((5-(4-chlorophenoxy)-1,3-dimethy
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    Mol. Formula:
    C23H23ClN4O5

    M.W.:
    470.91

    Type:
    Small molecule

    AlogP:
    4.25

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  12. ALA2251519

    Name:
    (E)-methyl 2-(2-(((1,3-dimethyl-5-(m-tolyloxy)-1H-
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    Mol. Formula:
    C24H26N4O5

    M.W.:
    450.50

    Type:
    Small molecule

    AlogP:
    3.90

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  13. ALA2251518

    Name:
    (E)-methyl 2-(2-(((1,3-dimethyl-5-(o-tolyloxy)-1H-
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    Mol. Formula:
    C24H26N4O5

    M.W.:
    450.50

    Type:
    Small molecule

    AlogP:
    3.90

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  14. ALA2251517

    Name:
    (E)-methyl 2-(2-((1,3-dimethyl-5-(p-tolyloxy)-1H-p
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    Mol. Formula:
    C24H26N4O5

    M.W.:
    450.50

    Type:
    Small molecule

    AlogP:
    3.90

    Polar Surface Area:
    96.53

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  15. ALA585679

    Name:
    5-Methyl-3-phenyl-2-p-tolyloxy-8,9,10,11-tetrahydr
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    Mol. Formula:
    C27H23N3O2S

    M.W.:
    453.57

    Type:
    Small molecule

    AlogP:
    6.28

    Polar Surface Area:
    57.01

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  16. ALA566702

    Name:
    5-Methyl-2-phenoxy-3-phenyl-8,9,10,11-tetrahydro-3
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    Mol. Formula:
    C26H21N3O2S

    M.W.:
    439.54

    Type:
    Small molecule

    AlogP:
    5.97

    Polar Surface Area:
    57.01

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  17. ALA583227

    Name:
    2-(2,4-Difluoro-phenoxy)-5-methyl-3-phenyl-8,9,10,
    Show More

    Mol. Formula:
    C26H19F2N3O2S

    M.W.:
    475.52

    Type:
    Small molecule

    AlogP:
    6.25

    Polar Surface Area:
    57.01

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  18. ALA443368

    Name:
    7alpha-Acetoxymultiplolide A

    Mol. Formula:
    C12H16O6

    M.W.:
    256.25

    Type:
    Small molecule

    AlogP:
    -0.06

    Polar Surface Area:
    85.36

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
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