Compounds

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ALA466558
Name:
2-Methoxy-6-decyl-1,4-benzoquinone
Mol. Formula:
C17H26O3
M.W.:
278.39
6 activity values
3 unique targets
Type:
Small molecule
AlogP:
4.13
Polar Surface Area:
43.37
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA500964
Name:
Oleanolic acid-3-O-beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl]-(1-Show More⌵
Mol. Formula:
C48H78O18
M.W.:
943.13
4 activity values
2 unique targets
Type:
Small molecule
AlogP:
0.71
Polar Surface Area:
294.98
HBA:
17
HBD:
11
#RO5 Violations:
3
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA107419
Name:
Disodium; 4-(phosphoniumoxy)benzyl 2-{(E)-[(aminocarbonothioyl)hydrazono]meShow More⌵
Mol. Formula:
C15H14N5Na2O6PS
M.W.:
469.33
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
1.88
Polar Surface Area:
168.72
HBA:
7
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA406056
Name:
Taxol analogue
Mol. Formula:
C60H66NNa2O19P
M.W.:
1182.13
4 activity values
1 unique targets
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA414997
Name:
Taxol analogue
Mol. Formula:
C60H66NNa2O19P
M.W.:
1182.13
2 activity values
1 unique targets
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE