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  1. ALA3274947

    Name:
    [123I]-6-Iododopamine bromide

    Mol. Formula:
    C8H11BrINO2

    M.W.:
    355.99

    Type:
    Small molecule

    AlogP:
    1.20

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  2. ALA3274492

    Name:
    [11C]-5,5-hexamethylene hydantoin

    Mol. Formula:
    C9H14N2O2

    M.W.:
    181.22

    Type:
    Small molecule

    AlogP:
    0.92

    Polar Surface Area:
    58.20

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.55

    DETAILS
  3. ALA2419500

    Name:
    Ethyl 5-Cyano-2-methyl-6-(3-{[(phenylsulfonyl)amino]-carbonyl}azetidin-1-ylShow More

    Mol. Formula:
    C20H20N4O5S

    M.W.:
    428.47

    Type:
    Small molecule

    AlogP:
    1.38

    Polar Surface Area:
    129.46

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  4. ALA1935590

    Name:
    7-(3-fluorophenylsulfonyl)-1,2,3,4-tetrahydrobenzofuro[2,3-c]pyridine

    Mol. Formula:
    C17H14FNO3S

    M.W.:
    331.37

    Type:
    Small molecule

    AlogP:
    3.05

    Polar Surface Area:
    59.31

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  5. ALA1923469

    Name:
    N-((3S)-1-(2-(7-acetyl-3,7-diazabicyclo[3.3.1]nonan-3-yl)-2-oxoethyl)-2-oxoShow More

    Mol. Formula:
    C26H31ClN4O5S

    M.W.:
    547.08

    Type:
    Small molecule

    AlogP:
    2.09

    Polar Surface Area:
    107.10

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  6. ALA1923468

    Name:
    6-Chloro-naphthalene-2-sulfonic acid{(S)-2-oxo-1-[2-oxo-2-((1R,5S)-8-oxo-1,Show More

    Mol. Formula:
    C28H29ClN4O5S

    M.W.:
    569.08

    Type:
    Small molecule

    AlogP:
    2.57

    Polar Surface Area:
    108.79

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
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