Your company account is blocked and you cannot place orders. If you have questions, please contact your company administrator.

Replicative DNA helicase

Name And Classification

ID:  ALA4511

Type:  SINGLE PROTEIN

Synonyms:   3.6.4.12 | dnaB | Replicative DNA helicase

Organism:  Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 / 1C / PRS 101 / LMG12228)

Species Group:  Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 / 1C / PRS 101 / LMG12228)

Protein Target Classification:   Enzyme / Hydrolase

Target Components

DescriptionRelationshipAccession
Replicative DNA helicasePROTEINQ9HUN3

Associated Active Ligands

  1. Tetrahydrouridine
    ALA204595

    Name:
    N2-(2-morpholinoethyl)-N4,N6-diphenyl-1,3,5-triazine-2,4,6-triamine

    Mol. Formula:
    C21H25N7O

    M.W.:
    391.48

    Type:
    Small molecule

    AlogP:
    3.10

    Polar Surface Area:
    87.23

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  2. Tetrahydrouridine
    ALA382869

    Name:
    1-(4-(4,6-bis(4-bromophenylamino)-1,3,5-triazin-2-ylamino)phenyl)ethanone

    Mol. Formula:
    C23H18Br2N6O

    M.W.:
    554.25

    Type:
    Small molecule

    AlogP:
    6.83

    Polar Surface Area:
    91.83

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  3. Tetrahydrouridine
    ALA203487

    Name:
    N2,N4-bis(4-methoxyphenyl)-N6-(2-morpholinoethyl)-1,3,5-triazine-2,4,6-triamine

    Mol. Formula:
    C23H29N7O3

    M.W.:
    451.53

    Type:
    Small molecule

    AlogP:
    3.12

    Polar Surface Area:
    105.69

    HBA:
    10

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  4. Tetrahydrouridine
    ALA380861

    Name:
    N2,N4-bis(4-fluorophenyl)-N6-(2-morpholinoethyl)-1,3,5-triazine-2,4,6-triamine

    Mol. Formula:
    C21H23F2N7O

    M.W.:
    427.46

    Type:
    Small molecule

    AlogP:
    3.38

    Polar Surface Area:
    87.23

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  5. Tetrahydrouridine
    ALA203116

    Name:
    N2,N4-bis(3,4-difluorophenyl)-N6-(2-morpholinoethyl)-1,3,5-triazine-2,4,6-triamine

    Mol. Formula:
    C21H21F4N7O

    M.W.:
    463.44

    Type:
    Small molecule

    AlogP:
    3.66

    Polar Surface Area:
    87.23

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  6. Tetrahydrouridine
    ALA204914

    Name:
    N2,N4-bis(4-fluorophenyl)-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine

    Mol. Formula:
    C20H21F2N7

    M.W.:
    397.43

    Type:
    Small molecule

    AlogP:
    3.39

    Polar Surface Area:
    69.21

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    0

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  7. Tetrahydrouridine
    ALA202736

    Name:
    N2,N4-bis(4-chlorophenyl)-N6-(2-morpholinoethyl)-1,3,5-triazine-2,4,6-triamine

    Mol. Formula:
    C21H23Cl2N7O

    M.W.:
    460.37

    Type:
    Small molecule

    AlogP:
    4.41

    Polar Surface Area:
    87.23

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  8. Tetrahydrouridine
    ALA202792

    Name:
    N2-(4-chlorophenyl)-N4-(2-morpholinoethyl)-N6-phenyl-1,3,5-triazine-2,4,6-triamine

    Mol. Formula:
    C21H24ClN7O

    M.W.:
    425.92

    Type:
    Small molecule

    AlogP:
    3.76

    Polar Surface Area:
    87.23

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  9. Tetrahydrouridine
    ALA204910

    Name:
    2-(4-(4,6-bis(4-fluorophenylamino)-1,3,5-triazin-2-yl)piperazin-1-yl)ethanol

    Mol. Formula:
    C21H23F2N7O

    M.W.:
    427.46

    Type:
    Small molecule

    AlogP:
    2.75

    Polar Surface Area:
    89.44

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  10. Tetrahydrouridine
    ALA205085

    Name:
    2-(4-(4,6-bis(3,4-difluorophenylamino)-1,3,5-triazin-2-yl)piperazin-1-yl)ethanol

    Mol. Formula:
    C21H21F4N7O

    M.W.:
    463.44

    Type:
    Small molecule

    AlogP:
    3.03

    Polar Surface Area:
    89.44

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS