Compounds

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ALA3038258
Name:
Purine-diphosphate-fucose analogue
Mol. Formula:
C16H23N5Na3O18P3
M.W.:
735.27
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
-3.07
Polar Surface Area:
358.28
HBA:
20
HBD:
10
#RO5 Violations:
3
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA3038257
Name:
Purine-diphosphate-fucose analogue
Mol. Formula:
C16H23N5Na2O15P2
M.W.:
633.31
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
-3.19
Polar Surface Area:
311.75
HBA:
18
HBD:
9
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.14
DETAILS
CLOSE
ALA2304277
Name:
Purine-diphosphate-fucose analogue
Mol. Formula:
C16H22N4Na2O15P2
M.W.:
618.29
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
-2.77
Polar Surface Area:
285.73
HBA:
17
HBD:
8
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA2304276
Name:
Purine-diphosphate-fucose analogue
Mol. Formula:
C16H23N5Na2O14P2
M.W.:
617.31
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
-2.89
Polar Surface Area:
291.52
HBA:
17
HBD:
8
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA2304275
Name:
Purine-diphosphate-fucose analogue
Mol. Formula:
C16H22N4Na2O16P2
M.W.:
634.29
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
-3.89
Polar Surface Area:
305.44
HBA:
16
HBD:
9
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE