Compounds

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ALA3343360
Name:
[1-(beta-D-Lactosyl)-1H-1,2,3-triazole-4-yl]methylguanosine diphosphate sodShow More⌵
Mol. Formula:
C25H37N8NaO21P2
M.W.:
870.54
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
-6.84
Polar Surface Area:
441.58
HBA:
26
HBD:
13
#RO5 Violations:
3
#Rotatable Bonds:
14
Passes Ro3:
N
QED Weighted:
0.07
DETAILS
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ALA3343359
Name:
[1-(beta-D-Galactopyranosyl)-1H-1,2,3-triazole-4-yl]methylguanosine diphospShow More⌵
Mol. Formula:
C19H27N8NaO16P2
M.W.:
708.40
2 activity values
1 unique targets
Type:
Small molecule
AlogP:
-4.66
Polar Surface Area:
362.43
HBA:
21
HBD:
10
#RO5 Violations:
3
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.08
DETAILS
CLOSE
ALA3343358
Name:
[1-(beta-D-Fucopyranosyl)-1H-1,2,3-triazole-4-yl]methylguanosine diphosphatShow More⌵
Mol. Formula:
C19H27N8NaO15P2
M.W.:
692.40
2 activity values
1 unique targets
Type:
Small molecule
AlogP:
-3.64
Polar Surface Area:
342.20
HBA:
20
HBD:
9
#RO5 Violations:
3
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA3343357
Name:
[1-(beta-L-Fucopyranosyl)-1H-1,2,3-triazole-4-yl]methylguanosine diphosphatShow More⌵
Mol. Formula:
C19H27N8NaO15P2
M.W.:
692.40
2 activity values
1 unique targets
Type:
Small molecule
AlogP:
-3.64
Polar Surface Area:
342.20
HBA:
20
HBD:
9
#RO5 Violations:
3
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA3343356
Name:
[(2R,3S,4R,5S,6S)-6-(aminomethyl)-3,4,5-trihydroxy-tetrahydropyran-2-yl][[(Show More⌵
Mol. Formula:
C16H26N6O15P2
M.W.:
604.36
3 activity values
1 unique targets
Type:
Small molecule
AlogP:
-4.66
Polar Surface Area:
337.51
HBA:
18
HBD:
10
#RO5 Violations:
3
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.12
DETAILS
CLOSE
ALA1232205
Name:
deoxyguanosine diphosphate
Mol. Formula:
C10H15N5O10P2
M.W.:
427.20
4 activity values
2 unique targets
Type:
Small molecule
AlogP:
-1.42
Polar Surface Area:
232.34
HBA:
11
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE