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  1. ALA2270131

    Name:
    3beta,24,25-trihydroxycycloartane

    Mol. Formula:
    C30H52O3

    M.W.:
    460.74

    Type:
    Small molecule

    AlogP:
    6.33

    Polar Surface Area:
    60.69

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  2. ALA2270130

    Name:
    Beddomeilactone

    Mol. Formula:
    C30H44O5

    M.W.:
    484.68

    Type:
    Small molecule

    AlogP:
    6.20

    Polar Surface Area:
    80.67

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  3. ALA2228238

    Name:
    N-(2,6-Difluorobenzoyl)-N'-(2,6-dimethyl-4-heptafluoroisopropylphenyl)-urea

    Mol. Formula:
    C19H13F9N2O2

    M.W.:
    472.31

    Type:
    Small molecule

    AlogP:
    5.83

    Polar Surface Area:
    58.20

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
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