Compounds

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ALA2289465
Name:
O,O'-Dimethyl alpha-(3-trifluoromethylphenoxyaceto
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Mol. Formula:
C17H17F3NO6P
M.W.:
419.29

6 activity values

6 unique targets
Type:
Small molecule
AlogP:
4.21
Polar Surface Area:
83.95
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.47
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ALA2289235
Name:
sodium methyl acetylphosphonate

Cas Number:
69103-75-9

Mol. Formula:
C3H6NaO4P
M.W.:
160.04

1 activity values

1 unique targets
Type:
Small molecule
AlogP:
0.36
Polar Surface Area:
63.60
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.56
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ALA2227929
Name:
(dimethoxyphosphoryl)methyl 2-(3-(trifluoromethyl)
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Mol. Formula:
C12H14F3O6P
M.W.:
342.21

51 activity values

12 unique targets
Type:
Small molecule
AlogP:
3.07
Polar Surface Area:
71.06
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE