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  1. 2,7-Dihydroxy-9-fluorenone

    Name:
    2,7-dihydroxy-9H-fluoren-9-one

    Mol. Formula:
    C13H8O3

    M.W.:
    212.20

    Type:
    Small molecule

    AlogP:
    2.31

    Polar Surface Area:
    57.53

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.60

    DETAILS
  2. ALA521787

    Name:
    2-(2-ethyl-4-(4-methoxyphenyl)-2-methyltetrahydro-2H-pyran-4-yl)ethanamine

    Mol. Formula:
    C17H27NO2

    M.W.:
    277.41

    Type:
    Small molecule

    AlogP:
    3.26

    Polar Surface Area:
    44.48

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.90

    DETAILS
  3. ALA491289

    Name:
    3-(furan-2-yl)-3-(2-methoxyphenyl)propan-1-amine

    Mol. Formula:
    C14H17NO2

    M.W.:
    231.29

    Type:
    Small molecule

    AlogP:
    2.77

    Polar Surface Area:
    48.39

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.86

    DETAILS
  4. ALA455684

    Name:
    2-amino-1-(10H-phenothiazin-10-yl)ethanone

    Mol. Formula:
    C14H12N2OS

    M.W.:
    256.33

    Type:
    Small molecule

    AlogP:
    2.77

    Polar Surface Area:
    46.33

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    Y

    QED Weighted:
    0.85

    DETAILS
  5. ALA490941

    Name:
    4-phenyl-N-(pyridin-4-yl)tetrahydro-2H-pyran-4-carboxamide

    Mol. Formula:
    C17H18N2O2

    M.W.:
    282.34

    Type:
    Small molecule

    AlogP:
    2.77

    Polar Surface Area:
    51.22

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.94

    DETAILS
  6. ALA489926

    Name:
    11-ketoestrone

    Mol. Formula:
    C18H20O3

    M.W.:
    284.36

    Type:
    Small molecule

    AlogP:
    3.00

    Polar Surface Area:
    54.37

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.80

    DETAILS
  7. ALA489925

    Name:
    2-(benzo[d]-2,1,3-thiadiazole-4-sulfonyl)-2-amino-2-phenyl-N-(pyridinyl-4)-Show More

    Mol. Formula:
    C19H15N5O3S2

    M.W.:
    425.50

    Type:
    Small molecule

    AlogP:
    2.74

    Polar Surface Area:
    113.94

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  8. ALA507264

    Name:
    alpha-ethyl-N-4-pyridinyl-benzeneacetamide

    Mol. Formula:
    C15H16N2O

    M.W.:
    240.31

    Type:
    Small molecule

    AlogP:
    3.21

    Polar Surface Area:
    41.99

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.89

    DETAILS
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