Compounds

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ALA1777875
Name:
trans-rac-2-(4-(2-chloro-4-(trifluoromethyl)phenox
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Mol. Formula:
C20H14ClF3O3
M.W.:
394.78

3 activity values

2 unique targets
Type:
Small molecule
AlogP:
5.52
Polar Surface Area:
46.53
HBA:
2
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA448569
Name:
5-octylthiazolidine-2,4-dione

Mol. Formula:
C11H19NO2S
M.W.:
229.34

Type:
Small molecule
AlogP:
3.09
Polar Surface Area:
46.17
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
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ALA389454
Name:
3-(4-pentyloxy-phenyl)-3-phenyl-propionic acid

Mol. Formula:
C20H24O3
M.W.:
312.41

3 activity values

2 unique targets
Type:
Small molecule
AlogP:
4.86
Polar Surface Area:
46.53
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE