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  1. ALA5094756

    Name:
    3-(4-(4-(methylthio)thiophen-3-yl)-1H-1,2,3-triazo
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    Mol. Formula:
    C12H12N4O2S2

    M.W.:
    308.39

    Type:
    Unknown

    AlogP:
    1.71

    Polar Surface Area:
    76.88

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  2. Type:
    Small molecule

    AlogP:
    3.36

    Polar Surface Area:
    105.98

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  3. ALA3989927

    Name:
    IBERDOMIDE

    Cas Number:
    1323403-33-3

    Mol. Formula:
    C25H27N3O5

    M.W.:
    449.51

    Type:
    Small molecule

    AlogP:
    1.86

    Polar Surface Area:
    88.18

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
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