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  1. ALA5278584

    Name:
    1-(p-tolylselanyl)propan-2-amine

    Mol. Formula:
    C10H15NSe

    M.W.:
    228.20

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  2. ALA4876463

    Name:
    (1,4-Phenylenebis(methanylylidene))bis(2-(1H-imidazol-4-yl)ethanamine)

    Mol. Formula:
    C18H20N6

    M.W.:
    320.40

    Type:
    Unknown

    AlogP:
    2.46

    Polar Surface Area:
    82.08

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  3. ALA4863985

    Name:
    (1,2-Phenylenebis(methanylylidene))bis(2-(1H-imidazol-4-yl)ethanamine)

    Mol. Formula:
    C18H20N6

    M.W.:
    320.40

    Type:
    Unknown

    AlogP:
    2.46

    Polar Surface Area:
    82.08

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  4. ALA4861675

    Name:
    2,5-Bis(4,5,6,7-tetrahydro-3H-imidazo [4,5-c]pyridin-4-yl)furan

    Mol. Formula:
    C16H18N6O

    M.W.:
    310.36

    Type:
    Unknown

    AlogP:
    1.20

    Polar Surface Area:
    94.56

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  5. ALA4856549

    Name:
    1,3-Bis(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-4-yl)benzene

    Mol. Formula:
    C18H20N6

    M.W.:
    320.40

    Type:
    Unknown

    AlogP:
    1.60

    Polar Surface Area:
    81.42

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  6. ALA4855463

    Name:
    1,3-Phenylenebis(methanylylidene))bis(2-(1H-imidazol-4-yl)ethanamine)

    Mol. Formula:
    C18H20N6

    M.W.:
    320.40

    Type:
    Unknown

    AlogP:
    2.46

    Polar Surface Area:
    82.08

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  7. ALA4846912

    Name:
    1,4-Bis(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-4-yl)benzene

    Mol. Formula:
    C18H20N6

    M.W.:
    320.40

    Type:
    Unknown

    AlogP:
    1.60

    Polar Surface Area:
    81.42

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  8. ALA4846641

    Name:
    Furan-2,5-diyIbis(methanylylidene)This(2-(1H-imidazol-4-yl)ethanamine)

    Mol. Formula:
    C16H18N6O

    M.W.:
    310.36

    Type:
    Unknown

    AlogP:
    2.05

    Polar Surface Area:
    95.22

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  9. ALA4649280

    Name:
    (2R,4S,5S)-1-(5-(Hydroxymethyl)-4-(4-(4-((2-oxo-2H-chromen-4-yl)oxy)-butyl)Show More

    Mol. Formula:
    C25H27N5O7

    M.W.:
    509.52

    Type:
    Unknown

    AlogP:
    1.47

    Polar Surface Area:
    154.47

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  10. ALA4644661

    Name:
    (2R,4S,5S)-1-(5-(Hydroxymethyl)-4-(4-(((2-oxo-2H-chromen-7-yl)oxy)-methyl)-Show More

    Mol. Formula:
    C22H21N5O7

    M.W.:
    467.44

    Type:
    Unknown

    AlogP:
    0.64

    Polar Surface Area:
    154.47

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  11. ALA4644555

    Name:
    (2R,4S,5S)-1-(5-(Hydroxymethyl)-4-(4-(3-((2-oxo-2H-chromen-7-yl)oxy)-propylShow More

    Mol. Formula:
    C24H25N5O7

    M.W.:
    495.49

    Type:
    Unknown

    AlogP:
    1.08

    Polar Surface Area:
    154.47

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  12. ALA4643353

    Name:
    (2S,3S,5R)-3-(3-((1-(2-(Hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrShow More

    Mol. Formula:
    C20H24N8O7S

    M.W.:
    520.53

    Type:
    Unknown

    AlogP:
    -1.07

    Polar Surface Area:
    216.32

    HBA:
    11

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  13. ALA4642896

    Name:
    4-(2-(bis((1-((2S,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydrShow More

    Mol. Formula:
    C34H42N12O10S

    M.W.:
    810.85

    Type:
    Unknown

    AlogP:
    -1.88

    Polar Surface Area:
    293.46

    HBA:
    19

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
  14. ALA4639447

    Name:
    (2R,4S,5S)-1-(5-(Hydroxymethyl)-4-(4-(3-((2-oxo-2H-chromen-6-yl)oxy)-propylShow More

    Mol. Formula:
    C24H25N5O7

    M.W.:
    495.49

    Type:
    Unknown

    AlogP:
    1.08

    Polar Surface Area:
    154.47

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  15. ALA4638601

    Name:
    (2R,4S,5S)-1-(5-(Hydroxymethyl)-4-(4-(4-((2-oxo-2H-chromen-7-yl)oxy)-butyl)Show More

    Mol. Formula:
    C25H27N5O7

    M.W.:
    509.52

    Type:
    Unknown

    AlogP:
    1.47

    Polar Surface Area:
    154.47

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  16. ALA4637598

    Name:
    (2S,3S,5R)-N-((1-(2-(Hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimiShow More

    Mol. Formula:
    C20H23N7O7S

    M.W.:
    505.51

    Type:
    Unknown

    AlogP:
    -1.46

    Polar Surface Area:
    204.29

    HBA:
    11

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  17. ALA4636477

    Name:
    (2S,3S,5R)-4-(3-(4-(((1-(2-(Hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydrShow More

    Mol. Formula:
    C26H28N8O6S2Se

    M.W.:
    691.65

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  18. ALA4635964

    Name:
    (2R,4S,5S)-1-(5-(Hydroxymethyl)-4-(4-(((2-oxo-2H-chromen-6-yl)oxy)-methyl)-Show More

    Mol. Formula:
    C22H21N5O7

    M.W.:
    467.44

    Type:
    Unknown

    AlogP:
    0.64

    Polar Surface Area:
    154.47

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  19. ALA4634647

    Name:
    (2S,3S,5R)-3-((1-(2-(Hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimiShow More

    Mol. Formula:
    C20H21N7O8S

    M.W.:
    519.50

    Type:
    Unknown

    AlogP:
    -1.44

    Polar Surface Area:
    210.33

    HBA:
    13

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  20. ALA4634543

    Name:
    (2S,3S,5R)-3-(3-(4-(((1-(2-(Hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydrShow More

    Mol. Formula:
    C26H28N8O6S2Se

    M.W.:
    691.65

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
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