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9 Items

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  1. ALA1078514

    Name:
    (2S)-2-[(2S)-2-[(2S)-2-{[(1R,4S,7R,10S,16S,19S,22S
    Show More

    Mol. Formula:
    C134H207N41O42S6

    M.W.:
    3256.78

    Type:
    Protein

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  2. ALA1078420

    Name:
    (2S)-2-[(2S)-2-[(2S)-2-{[(1R,4S,7R,10S,16S,19S,22S
    Show More

    Mol. Formula:
    C134H208N42O43S6

    M.W.:
    3287.79

    Type:
    Protein

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  3. ALA4294778

    Name:
    NA

    Mol. Formula:
    C132H197N35O40S6

    M.W.:
    3106.63

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  4. ALA4290331

    Name:
    NA

    Mol. Formula:
    C130H203N39O37S6

    M.W.:
    3096.69

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  5. ALA4277646

    Name:
    NA

    Mol. Formula:
    C132H208N38O37S6

    M.W.:
    3111.75

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  6. ALA2088126

    Name:
    (2R,5R,6S)-6-((3S,8S,9S,10R,13S,14S,16S,17R)-3,16-
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    Cas Number:
    123748-70-9

    Mol. Formula:
    C35H54O8

    M.W.:
    602.81

    Type:
    Small molecule

    AlogP:
    6.59

    Polar Surface Area:
    105.20

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  7. ALA2088125

    Name:
    (2R,5S,6S)-6-((3S,8S,9S,10R,13S,14S,16S,17R)-3,16-
    Show More

    Mol. Formula:
    C35H54O8

    M.W.:
    602.81

    Type:
    Small molecule

    AlogP:
    6.59

    Polar Surface Area:
    105.20

    HBA:
    8

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  8. ALA2088122

    Name:
    (23R,24S)-Chiograsterol A

    Mol. Formula:
    C27H46O5

    M.W.:
    450.66

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    97.99

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  9. ALA1223673

    Name:
    6,7-dibromo-4-oxo-1,4-dihydroquinoline-2-carboxyli
    Show More

    Mol. Formula:
    C10H5Br2NO3

    M.W.:
    346.96

    Type:
    Small molecule

    AlogP:
    2.75

    Polar Surface Area:
    70.16

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
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