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  1. ALA5072828

    Name:
    ANISODINE HYDROBROMIDE

    Mol. Formula:
    C17H22BrNO5

    M.W.:
    400.27

    Type:
    Unknown

    AlogP:
    0.02

    Polar Surface Area:
    82.53

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  2. BGP 15

    Name:
    BGP-15

    Mol. Formula:
    C14H24Cl2N4O2

    M.W.:
    351.28

    Type:
    Unknown

    AlogP:
    0.77

    Polar Surface Area:
    81.47

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  3. ALA4802124

    Name:
    ICOSAPENT

    Mol. Formula:
    C20H30O2

    M.W.:
    302.46

    Type:
    Unknown

    AlogP:
    5.99

    Polar Surface Area:
    37.30

    HBA:
    1

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  4. ALA4802123

    Name:
    LAPPACONITINE

    Mol. Formula:
    C32H44N2O8

    M.W.:
    584.71

    Type:
    Unknown

    AlogP:
    2.22

    Polar Surface Area:
    126.79

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  5. ALA4802121

    Name:
    TELAVANCIN

    Mol. Formula:
    C80H106Cl2N11O27P

    M.W.:
    1755.66

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  6. ALA4800594

    Name:
    METHYL-CHOLATE

    Mol. Formula:
    C25H42O5

    M.W.:
    422.61

    Type:
    Unknown

    AlogP:
    3.54

    Polar Surface Area:
    86.99

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  7. ALA4800463

    Name:
    EUCAINE-BETA

    Mol. Formula:
    C15H21NO2

    M.W.:
    247.34

    Type:
    Unknown

    AlogP:
    2.76

    Polar Surface Area:
    38.33

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.82

    DETAILS
  8. ALA4800421

    Name:
    BETA-AMYRIN

    Mol. Formula:
    C30H50O

    M.W.:
    426.73

    Type:
    Unknown

    AlogP:
    8.17

    Polar Surface Area:
    20.23

    HBA:
    1

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  9. ALA4800307

    Name:
    LASALOCID

    Mol. Formula:
    C34H54O8

    M.W.:
    590.80

    Type:
    Unknown

    AlogP:
    5.84

    Polar Surface Area:
    133.52

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  10. ALA4800278

    Name:
    OXIRAMIDE

    Mol. Formula:
    C25H34N2O2

    M.W.:
    394.56

    Type:
    Unknown

    AlogP:
    4.97

    Polar Surface Area:
    41.57

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  11. ALA4800156

    Name:
    ARGATROBAN MONOHYDRATE

    Mol. Formula:
    C23H36N6O5S

    M.W.:
    508.65

    Type:
    Unknown

    AlogP:
    0.91

    Polar Surface Area:
    177.71

    HBA:
    6

    HBD:
    6

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  12. ALA4800063

    Name:
    NAPSAGATRAN

    Mol. Formula:
    C26H34N6O6S

    M.W.:
    558.66

    Type:
    Unknown

    AlogP:
    0.67

    Polar Surface Area:
    185.99

    HBA:
    6

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  13. ALA4799859

    Name:
    SQ-32014

    Mol. Formula:
    C6H10N2O2

    M.W.:
    142.16

    Type:
    Unknown

    AlogP:
    1.22

    Polar Surface Area:
    65.18

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  14. ALA4799846

    Name:
    HYDROXYCHLOROQUINE (R*)

    Mol. Formula:
    C18H26ClN3O

    M.W.:
    335.88

    Type:
    Unknown

    AlogP:
    3.78

    Polar Surface Area:
    48.39

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  15. ALA4799824

    Name:
    ATIZORAM

    Mol. Formula:
    C18H24N2O3

    M.W.:
    316.40

    Type:
    Unknown

    AlogP:
    2.66

    Polar Surface Area:
    59.59

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.90

    DETAILS
  16. ALA4799741

    Name:
    DACH-PT(II)-BIS-ASCORBATE

    Mol. Formula:
    C6H8O6

    M.W.:
    176.12

    Type:
    Unknown

    AlogP:
    -1.41

    Polar Surface Area:
    107.22

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  17. ALA4799636

    Name:
    TEPROTIDE

    Mol. Formula:
    C53H76N14O12

    M.W.:
    1101.28

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  18. ALA4799620

    Name:
    CHOLEST-4,6-DIEN-3-ONE

    Mol. Formula:
    C27H42O

    M.W.:
    382.63

    Type:
    Unknown

    AlogP:
    7.37

    Polar Surface Area:
    17.07

    HBA:
    1

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  19. daglutril

    Name:
    DAGLUTRIL

    Mol. Formula:
    C31H38N2O6

    M.W.:
    534.65

    Type:
    Unknown

    AlogP:
    4.30

    Polar Surface Area:
    113.01

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  20. ALA4799594

    Name:
    NYSTATIN

    Mol. Formula:
    C47H75NO17

    M.W.:
    926.11

    Type:
    Unknown

    AlogP:
    0.94

    Polar Surface Area:
    319.61

    HBA:
    17

    HBD:
    12

    #RO5 Violations:
    3

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
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