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  1. ALA5176415

    Name:

    Mol. Formula:
    C24H27NO7

    M.W.:
    441.48

    Type:
    ---

    AlogP:
    3.23

    Polar Surface Area:
    133.16

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  2. ALA1773150

    Name:
    3-{3-[(1R,5S,7S,9S)-3,12-dihydroxy-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1Show More

    Mol. Formula:
    C24H27NO9

    M.W.:
    473.48

    Type:
    Small molecule

    AlogP:
    2.09

    Polar Surface Area:
    173.62

    HBA:
    8

    HBD:
    6

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  3. ALA1773149

    Name:
    3-(4-(2-(4-(2-hydroxy-3-methoxypropoxy)phenyl)propan-2-yl)phenoxy)propane-1Show More

    Mol. Formula:
    C22H30O6

    M.W.:
    390.48

    Type:
    Small molecule

    AlogP:
    2.13

    Polar Surface Area:
    88.38

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  4. ALA1773148

    Name:
    12-hydroxyplatencinic acid methyl ester

    Mol. Formula:
    C18H24O4

    M.W.:
    304.39

    Type:
    Small molecule

    AlogP:
    2.42

    Polar Surface Area:
    63.60

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  5. ALA1773147

    Name:
    3-((S)-5-Methyl-9-methylene-4-oxo-tricyclo[6.2.2.0*1,6*]dodec-2-en-5-yl)-prShow More

    Mol. Formula:
    C20H28O5

    M.W.:
    348.44

    Type:
    Small molecule

    AlogP:
    2.17

    Polar Surface Area:
    83.83

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  6. ALA1773146

    Name:
    platencin A11

    Mol. Formula:
    C24H29NO8

    M.W.:
    459.50

    Type:
    Small molecule

    AlogP:
    2.19

    Polar Surface Area:
    164.39

    HBA:
    7

    HBD:
    6

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  7. ALA1773145

    Name:
    Platencin A11 Methyl Ester

    Mol. Formula:
    C25H31NO8

    M.W.:
    473.52

    Type:
    Small molecule

    AlogP:
    2.28

    Polar Surface Area:
    153.39

    HBA:
    8

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  8. ALA1773144

    Name:
    platensimycin A6

    Mol. Formula:
    C24H29NO8

    M.W.:
    459.50

    Type:
    Small molecule

    AlogP:
    2.43

    Polar Surface Area:
    153.39

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  9. ALA1773143

    Name:
    platensimycin A6 methyl ester

    Mol. Formula:
    C25H31NO8

    M.W.:
    473.52

    Type:
    Small molecule

    AlogP:
    2.52

    Polar Surface Area:
    142.39

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  10. ALA1773142

    Name:
    platensimycin A5

    Mol. Formula:
    C24H29NO8

    M.W.:
    459.50

    Type:
    Small molecule

    AlogP:
    2.19

    Polar Surface Area:
    164.39

    HBA:
    7

    HBD:
    6

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  11. ALA1773141

    Name:
    platensimycin A5 methyl ester

    Mol. Formula:
    C25H31NO8

    M.W.:
    473.52

    Type:
    Small molecule

    AlogP:
    2.28

    Polar Surface Area:
    153.39

    HBA:
    8

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  12. ALA1773140

    Name:
    platensimycin A4

    Mol. Formula:
    C24H27NO8

    M.W.:
    457.48

    Type:
    Small molecule

    AlogP:
    2.21

    Polar Surface Area:
    153.39

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  13. ALA1773139

    Name:
    platensimycin A4 methyl ester

    Mol. Formula:
    C25H29NO8

    M.W.:
    471.51

    Type:
    Small molecule

    AlogP:
    2.29

    Polar Surface Area:
    142.39

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  14. ALA1773138

    Name:
    12beta-hydroxyplatensimycin

    Mol. Formula:
    C24H27NO8

    M.W.:
    457.48

    Type:
    Small molecule

    AlogP:
    2.35

    Polar Surface Area:
    153.39

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  15. ALA1773137

    Name:
    platensimycin A3 methyl ester

    Mol. Formula:
    C25H29NO8

    M.W.:
    471.51

    Type:
    Small molecule

    AlogP:
    2.44

    Polar Surface Area:
    142.39

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  16. ALA1773136

    Name:
    platensimycin A2

    Mol. Formula:
    C24H27NO8

    M.W.:
    457.48

    Type:
    Small molecule

    AlogP:
    2.20

    Polar Surface Area:
    153.39

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  17. ALA1773135

    Name:
    platensimycin A2 methyl ester

    Mol. Formula:
    C25H29NO8

    M.W.:
    471.51

    Type:
    Small molecule

    AlogP:
    2.29

    Polar Surface Area:
    142.39

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  18. ALA1773134

    Name:
    14-hydroxyplatensic acid methyl ester

    Mol. Formula:
    C18H24O5

    M.W.:
    320.39

    Type:
    Small molecule

    AlogP:
    1.63

    Polar Surface Area:
    72.83

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  19. ALA1773133

    Name:
    14-hydroxyplatensic acid

    Mol. Formula:
    C17H22O5

    M.W.:
    306.36

    Type:
    Small molecule

    AlogP:
    1.54

    Polar Surface Area:
    83.83

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  20. ALA1773132

    Name:
    platensic acid methyl ester

    Mol. Formula:
    C18H24O4

    M.W.:
    304.39

    Type:
    Small molecule

    AlogP:
    2.66

    Polar Surface Area:
    52.60

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
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