The page will load shortly, Thanks for your patience!
View as Grid List

7 Items

Set Ascending Direction
Select all
  1. ALA4217179

    Name:
    Palmarumycin B6; 6-Chloro-5-hydroxy-2,3-dihydro-4H
    Show More

    Mol. Formula:
    C20H13ClO4

    M.W.:
    352.77

    Type:
    Small molecule

    AlogP:
    4.80

    Polar Surface Area:
    55.76

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  2. ALA496641

    Name:
    (+/-)-5-(1,2-diacetoxyethyl)-2-(E)-hept-5-ene-1,3-
    Show More

    Mol. Formula:
    C17H16O4S

    M.W.:
    316.38

    Type:
    Small molecule

    AlogP:
    2.85

    Polar Surface Area:
    52.60

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  3. ALA488490

    Name:
    (+/-)-5-(1,2-dihydroxyethyl)-2-(E)-hept-5-ene-1,3-
    Show More

    Mol. Formula:
    C13H12O2S

    M.W.:
    232.30

    Type:
    Small molecule

    AlogP:
    1.70

    Polar Surface Area:
    40.46

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.76

    DETAILS
  4. ALA500347

    Name:
    5-hydroxymethyl-2-(E)-hept-5-ene-1,3-diynylthiophe
    Show More

    Mol. Formula:
    C12H10OS

    M.W.:
    202.28

    Type:
    Small molecule

    AlogP:
    2.17

    Polar Surface Area:
    20.23

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    Y

    QED Weighted:
    0.69

    DETAILS
  5. ALA496243

    Name:
    (+/-)-1,2-bis[5-(E)-hept-5-ene-1,3-diynylthiophen-
    Show More

    Mol. Formula:
    C27H20O3S2

    M.W.:
    456.59

    Type:
    Small molecule

    AlogP:
    4.72

    Polar Surface Area:
    54.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  6. ALA498465

    Name:
    (+/-)-5-(2-chloro-1-hydroxyethyl)-2-(E)-hept-5-ene
    Show More

    Mol. Formula:
    C13H11ClOS

    M.W.:
    250.75

    Type:
    Small molecule

    AlogP:
    2.95

    Polar Surface Area:
    20.23

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.63

    DETAILS
  7. ALA453761

    Name:
    2-(E)-hept-5-ene-1,3-diynylthiophene

    Mol. Formula:
    C11H8S

    M.W.:
    172.25

    Type:
    Small molecule

    AlogP:
    2.68

    Polar Surface Area:
    0.00

    HBA:
    1

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.53

    DETAILS
per page