Compounds

Select all

ALA2288840
Name:
(E)-3-(2-hydroxyphenyl)-1-(pyrazin-2-yl)prop-2-en-
Show More⌵

Mol. Formula:
C13H10N2O2
M.W.:
226.24

17 activity values

9 unique targets
Type:
Small molecule
AlogP:
2.08
Polar Surface Area:
63.08
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA388201
Name:
3-(7'-[1-(3,4-dichlorophenyl)-5-tetrazolylthio]hep
Show More⌵

Mol. Formula:
C32H38Cl2N4O2S
M.W.:
613.66

34 activity values

14 unique targets
Type:
Small molecule
AlogP:
8.52
Polar Surface Area:
69.90
HBA:
7
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA388200
Name:
3-(7'-[1-(4-chlorophenyl)-5-tetrazolylthio]heptylo
Show More⌵

Mol. Formula:
C32H39ClN4O2S
M.W.:
579.21

34 activity values

14 unique targets
Type:
Small molecule
AlogP:
7.86
Polar Surface Area:
69.90
HBA:
7
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
CLOSE