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  1. ALA2269098

    Name:
    5,7-Dimethylpyrazolo[3',4':4,5]thiazolo-[2,3-c]-1,2,4-triazole

    Mol. Formula:
    C7H7N5S

    M.W.:
    193.24

    Type:
    Small molecule

    AlogP:
    0.99

    Polar Surface Area:
    48.01

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  2. ALA454332

    Name:
    Abyssinone I

    Mol. Formula:
    C25H28O5

    M.W.:
    408.49

    Type:
    Small molecule

    AlogP:
    5.53

    Polar Surface Area:
    86.99

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  3. ALA455626

    Name:
    Abyssinone III

    Mol. Formula:
    C20H18O4

    M.W.:
    322.36

    Type:
    Small molecule

    AlogP:
    4.28

    Polar Surface Area:
    55.76

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  4. Phaseollin

    Name:
    Phaseollin

    Mol. Formula:
    C20H18O4

    M.W.:
    322.36

    Type:
    Small molecule

    AlogP:
    4.19

    Polar Surface Area:
    47.92

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  5. ALA455372

    Name:
    Erythrabyssin II

    Mol. Formula:
    C25H28O4

    M.W.:
    392.50

    Type:
    Small molecule

    AlogP:
    5.72

    Polar Surface Area:
    58.92

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
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