Compounds

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ALA3765349
Name:
(5R,7R,8R,9S,10R)-8,9,10-Tris(acetoxy)-7-(acetoxymethyl)-3-(naphthalen-2-ylShow More⌵
Mol. Formula:
C26H27NO10
M.W.:
513.50
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
2.42
Polar Surface Area:
136.02
HBA:
11
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA3763976
Name:
(5R,7R,8S,9S,10R)-3-(2,3-Dihydrobenzo-1,4-dioxin-6-yl)-1,6-dioxa-7-(hydroxyShow More⌵
Mol. Formula:
C16H19NO8
M.W.:
353.33
4 activity values
3 unique targets
Type:
Small molecule
AlogP:
-1.25
Polar Surface Area:
130.20
HBA:
9
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA3763929
Name:
(5R,7R,8S,9S,10R)-3-(Benzo-1,3-dioxol-5-yl)-1,6-dioxa-7-(hydroxymethyl)-2-aShow More⌵
Mol. Formula:
C15H17NO8
M.W.:
339.30
4 activity values
3 unique targets
Type:
Small molecule
AlogP:
-1.29
Polar Surface Area:
130.20
HBA:
9
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA3322300
Name:
5-Thioglucose
Mol. Formula:
C6H12O5S
M.W.:
196.22
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
-2.44
Polar Surface Area:
97.99
HBA:
6
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE