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  1. ALA4521731

    Name:
    8,9-dimethoxy-3-methyl-2-phenyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carShow More

    Mol. Formula:
    C22H20N2O2

    M.W.:
    344.41

    Type:
    Unknown

    AlogP:
    4.58

    Polar Surface Area:
    47.18

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  2. ALA4466298

    Name:
    ethyl 2-(3-aminophenyl)-8,9-dimethoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoShow More

    Mol. Formula:
    C24H26N2O4

    M.W.:
    406.48

    Type:
    Unknown

    AlogP:
    4.46

    Polar Surface Area:
    75.71

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  3. Cesium chloride

    Name:
    cesium chloride

    Mol. Formula:
    ClCs

    M.W.:
    168.36

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  4. ALA4458347

    Name:
    dihydro-beta-erythroidine hydrobromide

    Mol. Formula:
    C16H24BrNO3

    M.W.:
    358.28

    Type:
    Unknown

    AlogP:
    1.89

    Polar Surface Area:
    38.77

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  5. ALA4245528

    Name:
    NA

    Mol. Formula:
    C33H52O8

    M.W.:
    576.77

    Type:
    Small molecule

    AlogP:
    3.62

    Polar Surface Area:
    106.84

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  6. ALA3189038

    Name:
    SID118044105

    Mol. Formula:
    C23H22N2O3

    M.W.:
    374.44

    Type:
    Small molecule

    AlogP:
    4.90

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  7. ALA3188857

    Name:
    SID104221965

    Mol. Formula:
    C22H17F3N2O2

    M.W.:
    398.38

    Type:
    Small molecule

    AlogP:
    5.52

    Polar Surface Area:
    58.20

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  8. ALA3188749

    Name:
    SID118044113

    Mol. Formula:
    C22H17F3N2O4

    M.W.:
    430.38

    Type:
    Small molecule

    AlogP:
    5.10

    Polar Surface Area:
    76.66

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  9. ALA3188358

    Name:
    SID118044114

    Mol. Formula:
    C21H18N2O3

    M.W.:
    346.39

    Type:
    Small molecule

    AlogP:
    4.20

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  10. ALA3188343

    Name:
    SID113635255

    Mol. Formula:
    C21H18N2O3

    M.W.:
    346.39

    Type:
    Small molecule

    AlogP:
    4.20

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  11. ALA3188305

    Name:
    SID121282408

    Mol. Formula:
    C22H20N2O4

    M.W.:
    376.41

    Type:
    Small molecule

    AlogP:
    4.21

    Polar Surface Area:
    76.66

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  12. ALA3188247

    Name:
    SID110923104

    Mol. Formula:
    C23H28N2O3

    M.W.:
    380.49

    Type:
    Small molecule

    AlogP:
    5.25

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  13. ALA3188141

    Name:
    SID117689421

    Mol. Formula:
    C23H19F3N2O3

    M.W.:
    428.41

    Type:
    Small molecule

    AlogP:
    5.61

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  14. ALA3188099

    Name:
    SID110923097

    Mol. Formula:
    C20H22N2O3

    M.W.:
    338.41

    Type:
    Small molecule

    AlogP:
    4.08

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.86

    DETAILS
  15. ALA3188074

    Name:
    SID118044108

    Mol. Formula:
    C23H19F3N2O4

    M.W.:
    444.41

    Type:
    Small molecule

    AlogP:
    5.49

    Polar Surface Area:
    76.66

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  16. ALA3187977

    Name:
    SID117689432

    Mol. Formula:
    C23H22N2O3

    M.W.:
    374.44

    Type:
    Small molecule

    AlogP:
    4.90

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  17. ALA3187806

    Name:
    SID104221971

    Mol. Formula:
    C22H20N2O3

    M.W.:
    360.41

    Type:
    Small molecule

    AlogP:
    4.51

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  18. ALA3187764

    Name:
    SID118044110

    Mol. Formula:
    C24H24N2O3

    M.W.:
    388.47

    Type:
    Small molecule

    AlogP:
    5.32

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  19. ALA3187490

    Name:
    SID124756557

    Mol. Formula:
    C25H20N2O3

    M.W.:
    396.45

    Type:
    Small molecule

    AlogP:
    5.35

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  20. ALA3187482

    Name:
    SID113635250

    Mol. Formula:
    C23H22N2O3

    M.W.:
    374.44

    Type:
    Small molecule

    AlogP:
    4.90

    Polar Surface Area:
    67.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
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