Compounds

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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-methoxyphenyl)prop-2-en-1-one
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-yn-1-one
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
ALA1099306
Name:
2-[4-({[2-({[3,5-bis(2-{[3,5-bis({[1-(5-{[(1R)-1-{[(4R,7S,10S,13R,16S,19R)-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
ALA573846
Name:
[11C]-1-(beta-D-Galactopyranosyl)-4-(6-methoxynaphthyl)-1,2,3-triazole
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