Compounds

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ALA2251845
Name:
Saflufenacil
Mol. Formula:
C17H17ClF4N4O5S
M.W.:
500.86
18 activity values
3 unique targets
Type:
Small molecule
AlogP:
1.66
Polar Surface Area:
110.48
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
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ALA2230196
Name:
(2E)-4-oxohexadec-2-enoic acid
Mol. Formula:
C16H27NaO3
M.W.:
290.38
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
4.51
Polar Surface Area:
54.37
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA489337
Name:
hipppamine
Mol. Formula:
C17H19NO4
M.W.:
301.34
7 activity values
7 unique targets
Type:
Small molecule
AlogP:
1.40
Polar Surface Area:
51.16
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE