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  1. ALA563044

    Name:
    1,3-Dibenzyl-2-methyl 2-(2-phenoxyacetamido)aminopropane-1,2,3-tricarboxylaShow More

    Mol. Formula:
    C29H29NO8

    M.W.:
    519.55

    Type:
    Small molecule

    AlogP:
    3.36

    Polar Surface Area:
    117.23

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  2. ALA561555

    Name:
    2-Benzyl-1,3-dimethyl 2-aminopropane-1,2,3-tricarboxylate

    Mol. Formula:
    C15H19NO6

    M.W.:
    309.32

    Type:
    Small molecule

    AlogP:
    0.55

    Polar Surface Area:
    104.92

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  3. ALA553476

    Name:
    Tribenzyl 2-(2-phenoxyacetamido)aminopropane-1,2,3-tricarboxylate

    Mol. Formula:
    C35H33NO8

    M.W.:
    595.65

    Type:
    Small molecule

    AlogP:
    4.93

    Polar Surface Area:
    117.23

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
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