Compounds

Select all

ALA1099306
Name:
2-[4-({[2-({[3,5-bis(2-{[3,5-bis({[1-(5-{[(1R)-1-{
Show More⌵

Mol. Formula:
C275H364N60O66S9
M.W.:
5854.89

34 activity values

9 unique targets
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3601608
Name:
4-(3,5-dihydroxystyryl)phenyl 2-hydroxybenzoate

Mol. Formula:
C21H16O5
M.W.:
348.35

9 activity values

6 unique targets
Type:
Small molecule
AlogP:
4.19
Polar Surface Area:
86.99
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA1830026
Name:
[125I]-(E)-1-(5-iodo-1H-indol-1-yl)-3-(4-methoxyph
Show More⌵

Mol. Formula:
C18H14INO2
M.W.:
401.22

55 activity values

10 unique targets
Type:
Small molecule
AlogP:
4.61
Polar Surface Area:
31.23
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA1643336
Name:
3-[4-(dimethylamino)phenyl]-1-(4-iodophenyl)prop-2
Show More⌵

Mol. Formula:
C17H14INO
M.W.:
373.21

36 activity values

9 unique targets
Type:
Small molecule
AlogP:
3.59
Polar Surface Area:
20.31
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA573846
Name:
[11C]-1-(beta-D-Galactopyranosyl)-4-(6-methoxynaph
Show More⌵

Mol. Formula:
C19H21N3O6
M.W.:
386.39

45 activity values

12 unique targets
Type:
Small molecule
AlogP:
0.08
Polar Surface Area:
130.09
HBA:
9
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE