The store will not work correctly when cookies are disabled.
The page will load shortly, Thanks for your patience!
Select all
ALA5192244 Name:
1',1'''-(propane-1,3-diyl)bis(4-methylene-3,4-dihydro-5H-spiro[furan-2,3'-iShow More⌵
Mol. Formula:
C27H22N2O6
M.W.:
470.48
Type:
---
AlogP:
2.87
Polar Surface Area:
93.22
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4469909 Name:
(1R,2R,4aS,5R)-1-(hydroxymethyl)-1,4a-dimethyl-6-methylene-5-(2-(4-nitropheShow More⌵
Mol. Formula:
C22H31NO5
M.W.:
389.49
Type:
Unknown
AlogP:
4.11
Polar Surface Area:
92.83
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4440378 Name:
2',4,4'-trihydroxy-6'-methoxy-3'(3''-hydroxybenzyl)dihydrochalcone
Mol. Formula:
C23H20O6
M.W.:
392.41
Type:
Unknown
AlogP:
4.00
Polar Surface Area:
107.22
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4217519 Name:
Frutescone O
Mol. Formula:
C24H36O3
M.W.:
372.55
Type:
Small molecule
AlogP:
5.66
Polar Surface Area:
35.53
HBA:
3
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4214012 Name:
Violacin A
Mol. Formula:
C13H14O5
M.W.:
250.25
Type:
Small molecule
AlogP:
1.33
Polar Surface Area:
83.83
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA3357931 Name:
Curcumolide
Mol. Formula:
C15H22O3
M.W.:
250.34
Type:
Small molecule
AlogP:
2.44
Polar Surface Area:
46.53
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
Y
QED Weighted:
0.57
DETAILS
CLOSE
ALA3329992 Name:
3-(4-(N-(2-(1-ethyl-2-methyl-1H-indol-3-yl)ethyl)sulfamoyl)phenyl)-N-hydroxShow More⌵
Mol. Formula:
C22H25N3O4S
M.W.:
427.53
Type:
Small molecule
AlogP:
3.01
Polar Surface Area:
100.43
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA3329991 Name:
N-hydroxy-3-{4-[2-(2-methyl-1H-indol-3-yl)-ethylsulfamoyl]-phenyl}-acrylamiShow More⌵
Mol. Formula:
C20H21N3O4S
M.W.:
399.47
Type:
Small molecule
AlogP:
2.52
Polar Surface Area:
111.29
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA3329990 Name:
3-{4-[2-(1,2-Dimethyl-1H-indol-3-yl)-ethyl-N-tertbutoxycarbonylsulfamoyl]-pShow More⌵
Mol. Formula:
C21H23N3O4S
M.W.:
413.50
Type:
Small molecule
AlogP:
2.53
Polar Surface Area:
100.43
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA3085908 Name:
KFFKKLKNSVKKRAKKFFKKPRVIGVSIPF
Mol. Formula:
C175H289N47O34
M.W.:
3595.53
Type:
Protein
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
Shop By
Filters Level 1 ATC Code Description
Level 2 ATC Code Description