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6 Items

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  1. ALA4520035

    Name:
    6-[(2,2-dioxido-1,3-dihydro-2,1-benzothiazol-5-yl)
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    Mol. Formula:
    C21H18N4O4S

    M.W.:
    422.47

    Type:
    Unknown

    AlogP:
    1.89

    Polar Surface Area:
    112.23

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  2. ALA4530832

    Name:
    4-[(4-oxo-2-phenyl-3,5,7,8-tetrahydropyrido[4,3-d]
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    Mol. Formula:
    C21H17N3O4

    M.W.:
    375.38

    Type:
    Unknown

    AlogP:
    2.33

    Polar Surface Area:
    103.36

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  3. ALA4459818

    Name:
    4-[(8-methyl-4-oxo-2-phenyl-3,5,7,8-tetrahydropyri
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    Mol. Formula:
    C22H19N3O4

    M.W.:
    389.41

    Type:
    Unknown

    AlogP:
    2.89

    Polar Surface Area:
    103.36

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  4. ALA4440948

    Name:
    4-[(3-methyl-4-oxo-2-phenyl-3,5,7,8-tetrahydropyri
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    Mol. Formula:
    C22H19N3O4

    M.W.:
    389.41

    Type:
    Unknown

    AlogP:
    2.34

    Polar Surface Area:
    92.50

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  5. ALA1233930

    Name:
    (S)-2-(4-((R)-3-amino-1-hydroxy-9-oxo-5,6,6a,7-tet
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    Mol. Formula:
    C20H21N7O7

    M.W.:
    471.43

    Type:
    Small molecule

    AlogP:
    0.05

    Polar Surface Area:
    211.31

    HBA:
    9

    HBD:
    6

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  6. ALA12213

    Name:
    2-{4-[2-(2-amino-5-methyl-4-oxo-1,4,5,6,7,8-hexahy
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    Mol. Formula:
    C21H27N7O6

    M.W.:
    473.49

    Type:
    Small molecule

    AlogP:
    0.13

    Polar Surface Area:
    202.77

    HBA:
    9

    HBD:
    7

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
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