Compounds

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ALA1254688
Name:
2,4-Dinitrophenyl alpha-D-mannopyranoside
Mol. Formula:
C12H14N2O10
M.W.:
346.25
14 activity values
1 unique targets
Type:
Small molecule
AlogP:
-1.32
Polar Surface Area:
185.66
HBA:
10
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
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ALA1254687
Name:
alpha-1,6-mannobiose
Mol. Formula:
C12H22O11
M.W.:
342.30
24 activity values
1 unique targets
Type:
Small molecule
AlogP:
-5.40
Polar Surface Area:
189.53
HBA:
11
HBD:
8
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA1254686
Name:
alpha-1,4-Mannobiose
Mol. Formula:
C12H22O11
M.W.:
342.30
37 activity values
1 unique targets
Type:
Small molecule
AlogP:
-5.40
Polar Surface Area:
189.53
HBA:
11
HBD:
8
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA1234169
Name:
alpha-1,3-Mannobiose
Mol. Formula:
C12H22O11
M.W.:
342.30
40 activity values
1 unique targets
Type:
Small molecule
AlogP:
-5.40
Polar Surface Area:
189.53
HBA:
11
HBD:
8
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
Kifunensine
Name:
(5R,6R,7S,8R,8aS)-Hexahydro-6,7,8-trihydroxy-5-(hydroxymethyl)-imidazo[1,2-Show More⌵
Mol. Formula:
C8H12N2O6
M.W.:
232.19
13 activity values
5 unique targets
Type:
Small molecule
AlogP:
-4.27
Polar Surface Area:
130.33
HBA:
6
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA1229953
Name:
alpha-1,2-Mannobiose
Mol. Formula:
C12H22O11
M.W.:
342.30
79 activity values
1 unique targets
Type:
Small molecule
AlogP:
-5.40
Polar Surface Area:
189.53
HBA:
11
HBD:
8
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE