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  1. ALA2110262

    Name:
    (+)-4-Chloro-N-{(1S)-2,2-dichloro-1-[N'-(6-chlorop
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    Mol. Formula:
    C17H14Cl4N6O

    M.W.:
    460.15

    Type:
    Small molecule

    AlogP:
    4.18

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  2. ALA238855

    Name:
    N-{2,2-dichloro-1-[N'-cyano-N''-(6-fluoropyridin-3
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    Mol. Formula:
    C17H14Cl2F2N6O

    M.W.:
    427.24

    Type:
    Small molecule

    AlogP:
    3.15

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  3. ALA393952

    Name:
    N-{2,2-dichloro-1-[N'-cyano-N''-(6-fluoropyridin-3
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    Mol. Formula:
    C18H14Cl2F4N6O2

    M.W.:
    493.25

    Type:
    Small molecule

    AlogP:
    3.91

    Polar Surface Area:
    111.43

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  4. ALA238854

    Name:
    N-{2,2-dichloro-1-[N'-cyano-N''-(6-fluoropyridin-3
    Show More

    Mol. Formula:
    C17H13Cl2F3N6O

    M.W.:
    445.23

    Type:
    Small molecule

    AlogP:
    3.29

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  5. ALA238640

    Name:
    N-{2,2-dichloro-1-[N'-cyano-N''-(6-fluoroypyridin-
    Show More

    Mol. Formula:
    C18H17Cl2FN6O

    M.W.:
    423.28

    Type:
    Small molecule

    AlogP:
    3.32

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  6. ALA238639

    Name:
    N-{2,2-dichloro-1-[N'-cyano-N''-(6-fluoropyridin-3
    Show More

    Mol. Formula:
    C18H17Cl2FN6O

    M.W.:
    423.28

    Type:
    Small molecule

    AlogP:
    3.32

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  7. ALA436805

    Name:
    thiophene-2-carboxylic acid {2,2-dichloro-1-[N'-cy
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    Mol. Formula:
    C15H13Cl2FN6OS

    M.W.:
    415.28

    Type:
    Small molecule

    AlogP:
    3.07

    Polar Surface Area:
    102.20

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  8. ALA238638

    Name:
    3-chloro-N-{2,2-dichloro-1-[N'-cyano-N''-(6-fluoro
    Show More

    Mol. Formula:
    C17H14Cl3FN6O

    M.W.:
    443.70

    Type:
    Small molecule

    AlogP:
    3.66

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  9. ALA238422

    Name:
    3,5-dichloro-N-{2,2-dichloro-1-[N'-cyano-N''-(6-fl
    Show More

    Mol. Formula:
    C17H13Cl4FN6O

    M.W.:
    478.14

    Type:
    Small molecule

    AlogP:
    4.32

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
  10. ALA392291

    Name:
    N-{1-[N'-(5-bromopyridin-3-yl)-N''-cyanoguanidino]
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    Mol. Formula:
    C18H14BrCl2F3N6O2

    M.W.:
    554.15

    Type:
    Small molecule

    AlogP:
    4.53

    Polar Surface Area:
    111.43

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  11. ALA241411

    Name:
    N-{1-[N'-(5-bromopyridin-3-yl)-N''-cyanoguanidino]
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    Mol. Formula:
    C17H13BrCl4N6O

    M.W.:
    539.05

    Type:
    Small molecule

    AlogP:
    4.94

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  12. ALA241410

    Name:
    N-{1-[N'-(5-bromopyridin-3-yl)-N''-cyanoguanidino]
    Show More

    Mol. Formula:
    C18H17BrCl2N6O

    M.W.:
    484.19

    Type:
    Small molecule

    AlogP:
    3.94

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  13. ALA241409

    Name:
    thiophene-2-carboxylic acid {1-[N'-(5-bromopyridin
    Show More

    Mol. Formula:
    C15H13BrCl2N6OS

    M.W.:
    476.19

    Type:
    Small molecule

    AlogP:
    3.69

    Polar Surface Area:
    102.20

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  14. ALA393425

    Name:
    N-{1-[N'-(5-bromopyridin-3-yl)-N''-cyanoguanidino]
    Show More

    Mol. Formula:
    C18H17BrCl2N6O

    M.W.:
    484.19

    Type:
    Small molecule

    AlogP:
    3.94

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  15. ALA241200

    Name:
    N-{1-[N'-(5-Bromopyridin-3-yl)-N''-cyanoguanidino]
    Show More

    Mol. Formula:
    C17H13BrCl2F2N6O

    M.W.:
    506.14

    Type:
    Small molecule

    AlogP:
    3.91

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  16. ALA393424

    Name:
    N-{1-[N'-(5-bromopyridin-3-yl)-N''-cyanoguanidino]
    Show More

    Mol. Formula:
    C17H14BrCl2FN6O

    M.W.:
    488.15

    Type:
    Small molecule

    AlogP:
    3.77

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  17. ALA241199

    Name:
    N-{1-[N'-(5-bromopyridin-3-yl)-N''-cyanoguanidino]
    Show More

    Mol. Formula:
    C17H14BrCl3N6O

    M.W.:
    504.60

    Type:
    Small molecule

    AlogP:
    4.29

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  18. ALA241198

    Name:
    4-bromo-N-{2,2-dichloro-1-[N'-cyano-N''-(6-trifluo
    Show More

    Mol. Formula:
    C18H14BrCl2F3N6O

    M.W.:
    538.16

    Type:
    Small molecule

    AlogP:
    4.65

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  19. ALA240989

    Name:
    N-{2,2-dichloro-1-[N'-cyano-N''-(6-trifluoromethyl
    Show More

    Mol. Formula:
    C18H14Cl2F3IN6O

    M.W.:
    585.16

    Type:
    Small molecule

    AlogP:
    4.49

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  20. ALA392290

    Name:
    3-chloro-N-{2,2-dichloro-1-[N'-cyano-N''-(6-triflu
    Show More

    Mol. Formula:
    C18H14Cl3F3N6O

    M.W.:
    493.70

    Type:
    Small molecule

    AlogP:
    4.54

    Polar Surface Area:
    102.20

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
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