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  1. ALA1086654

    Name:
    Phantasmidine

    Mol. Formula:
    C11H11ClN2O

    M.W.:
    222.67

    Type:
    Small molecule

    AlogP:
    1.72

    Polar Surface Area:
    34.15

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.68

    DETAILS
  2. ALA4092845

    Name:
    6,7-Dimethoxy-2-ethyl-2-methyl-1,2,3,4-tetrahydroi
    Show More

    Mol. Formula:
    C14H22INO2

    M.W.:
    363.24

    Type:
    Small molecule

    AlogP:
    2.23

    Polar Surface Area:
    18.46

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.75

    DETAILS
  3. ALA4092784

    Name:
    1-(3-Bromophenethyl)imidazolidin-2-imine

    Mol. Formula:
    C11H14BrN3

    M.W.:
    268.16

    Type:
    Small molecule

    AlogP:
    1.83

    Polar Surface Area:
    39.12

    HBA:
    1

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.88

    DETAILS
  4. ALA4092192

    Name:
    NA

    Mol. Formula:
    C56H92N16O18S5

    M.W.:
    1437.78

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  5. ALA4091711

    Name:
    NA

    Mol. Formula:
    C59H94N18O17S4

    M.W.:
    1455.78

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  6. ALA4090594

    Name:
    (S)-1-(3-(2-Imino-3-(2-(pyridin-3-yl)ethyl)imidazo
    Show More

    Mol. Formula:
    C14H23N7

    M.W.:
    289.39

    Type:
    Small molecule

    AlogP:
    0.10

    Polar Surface Area:
    113.91

    HBA:
    3

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  7. ALA4089797

    Name:
    NA

    Mol. Formula:
    C59H94N18O17S5

    M.W.:
    1487.85

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  8. ALA4089792

    Name:
    1-(3-Fluorophenethyl)imidazolidin-2-imine

    Mol. Formula:
    C11H14FN3

    M.W.:
    207.25

    Type:
    Small molecule

    AlogP:
    1.21

    Polar Surface Area:
    39.12

    HBA:
    1

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.78

    DETAILS
  9. ALA4089727

    Name:
    NA

    Mol. Formula:
    C63H95N21O19S4

    M.W.:
    1578.85

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  10. ALA4089684

    Name:
    (S)-5-Methyl-1-(pyridin-3-ylmethyl)imidazolidin-2-
    Show More

    Mol. Formula:
    C10H14N4

    M.W.:
    190.25

    Type:
    Small molecule

    AlogP:
    0.81

    Polar Surface Area:
    52.01

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.73

    DETAILS
  11. ALA4089306

    Name:
    NA

    Mol. Formula:
    C57H92N18O18S5

    M.W.:
    1477.81

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  12. ALA4088860

    Name:
    (R)-(3-(3-Bromophenethyl)-2-iminoimidazolidin-4-yl
    Show More

    Mol. Formula:
    C12H16BrN3O

    M.W.:
    298.18

    Type:
    Small molecule

    AlogP:
    1.19

    Polar Surface Area:
    59.35

    HBA:
    2

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  13. ALA4084130

    Name:
    2-Benzyl-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydro
    Show More

    Mol. Formula:
    C19H24BrNO2

    M.W.:
    378.31

    Type:
    Small molecule

    AlogP:
    3.41

    Polar Surface Area:
    18.46

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  14. ALA4083525

    Name:
    6-Benzyloxy-2,2-dimethyl-7-methoxy-1,2,3,4-tetrahy
    Show More

    Mol. Formula:
    C19H24INO2

    M.W.:
    425.31

    Type:
    Small molecule

    AlogP:
    3.41

    Polar Surface Area:
    18.46

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  15. ALA4081935

    Name:
    NA

    Mol. Formula:
    C57H92N18O18S5

    M.W.:
    1477.81

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  16. ALA4081815

    Name:
    1-(Pyridin-4-ylmethyl)imidazolidin-2-imine

    Mol. Formula:
    C9H12N4

    M.W.:
    176.22

    Type:
    Small molecule

    AlogP:
    0.42

    Polar Surface Area:
    52.01

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.69

    DETAILS
  17. ALA4081435

    Name:
    NA

    Mol. Formula:
    C57H88N18O20S5

    M.W.:
    1505.77

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  18. ALA4068559

    Name:
    1-Phenethylimidazolidin-2-imine

    Mol. Formula:
    C11H15N3

    M.W.:
    189.26

    Type:
    Small molecule

    AlogP:
    1.07

    Polar Surface Area:
    39.12

    HBA:
    1

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.75

    DETAILS
  19. ALA4067640

    Name:
    (S)-1-(2-(6-Chloropyridin-3-yl)ethyl)-5-methylimid
    Show More

    Mol. Formula:
    C11H15ClN4

    M.W.:
    238.72

    Type:
    Small molecule

    AlogP:
    1.51

    Polar Surface Area:
    52.01

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.79

    DETAILS
  20. ALA4084577

    Name:
    (S)-5-Methyl-1-(2-(pyridin-3-yl)ethyl)imidazolidin
    Show More

    Mol. Formula:
    C11H16N4

    M.W.:
    204.28

    Type:
    Small molecule

    AlogP:
    0.85

    Polar Surface Area:
    52.01

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.77

    DETAILS
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