Compounds

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ALA4217371
Name:
Methyl 2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2R,3R,4R)-4-acetoxy-3-methShow More⌵
Mol. Formula:
C28H46O7
M.W.:
494.67
2 activity values
1 unique targets
Type:
Small molecule
AlogP:
5.02
Polar Surface Area:
83.59
HBA:
7
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4212417
Name:
Methyl 2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2S,3R)-3-methoxy-4-oxopentShow More⌵
Mol. Formula:
C26H42O6
M.W.:
450.62
2 activity values
1 unique targets
Type:
Small molecule
AlogP:
4.66
Polar Surface Area:
74.36
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
Herboxidiene
Name:
2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2R,3R,4R)-4-hydroxy-3-methoxypentShow More⌵
Mol. Formula:
C25H42O6
M.W.:
438.61
21 activity values
5 unique targets
Type:
Small molecule
AlogP:
4.36
Polar Surface Area:
88.52
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE