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  1. 5-Cyanouracil

    Name:
    2,4-Dioxo-1,2,3,4-tetrahydro-pyrimidine-5-carbonitrile

    Mol. Formula:
    C5H3N3O2

    M.W.:
    137.10

    Type:
    Small molecule

    AlogP:
    -0.24

    Polar Surface Area:
    90.03

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  2. ALA352944

    Name:
    5-((E)-Styryl)-1H-pyrimidine-2,4-dione

    Mol. Formula:
    C12H10N2O2

    M.W.:
    214.22

    Type:
    Small molecule

    AlogP:
    2.06

    Polar Surface Area:
    66.24

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  3. 5-Ethynyluracil

    Name:
    5-Ethynyl-1H-pyrimidine-2,4-dione

    Mol. Formula:
    C6H4N2O2

    M.W.:
    136.11

    Type:
    Small molecule

    AlogP:
    -0.96

    Polar Surface Area:
    65.72

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
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