The store will not work correctly when cookies are disabled.
The page will load shortly, Thanks for your patience!
Select all
ALA4517144 Name:
1-(4-hydroxy-3-methoxyphenyl)-7-(3-methoxy-4-((3R,
Show More⌵
Mol. Formula:
C27H30O11
M.W.:
530.53
Type:
Unknown
AlogP:
0.84
Polar Surface Area:
172.21
HBA:
11
HBD:
5
#RO5 Violations:
2
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4778986 Name:
Androsamide
Mol. Formula:
C29H43N5O6S
M.W.:
589.76
Type:
Unknown
AlogP:
1.54
Polar Surface Area:
144.07
HBA:
7
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA5282555 Name:
N-(4-(7-(1-acetyl-1,2,3,6-tetrahydropyridin-4-yl)i
Show More⌵
Mol. Formula:
C25H21N5O5
M.W.:
471.47
Type:
---
AlogP:
4.39
Polar Surface Area:
122.99
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5282111 Name:
2,6-bis(4-ethoxy-3-methoxybenzylidene)cyclohexan-1
Show More⌵
Mol. Formula:
C26H30O5
M.W.:
422.52
Type:
---
AlogP:
5.72
Polar Surface Area:
53.99
HBA:
5
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA5282080 Name:
Ophiopogonin B
Mol. Formula:
C39H62O12
M.W.:
722.91
Type:
---
AlogP:
2.39
Polar Surface Area:
176.76
HBA:
12
HBD:
6
#RO5 Violations:
3
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA5280649 Name:
3-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxyme
Show More⌵
Mol. Formula:
C45H74O10
M.W.:
775.08
Type:
---
AlogP:
8.44
Polar Surface Area:
151.98
HBA:
10
HBD:
4
#RO5 Violations:
2
#Rotatable Bonds:
33
Passes Ro3:
N
QED Weighted:
0.03
DETAILS
CLOSE
ALA5280625 Name:
N-(4-(7-(azetidin-1-yl)imidazo[1,2-a]pyridin-3-yl)
Show More⌵
Mol. Formula:
C21H17N5O4
M.W.:
403.40
Type:
---
AlogP:
3.96
Polar Surface Area:
105.92
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5279832 Name:
2-(palmitoyloxy)-3-(((2R,3R,4S,5R,6R)-3,4,5-trihyd
Show More⌵
Mol. Formula:
C43H76O10
M.W.:
753.07
Type:
---
AlogP:
8.33
Polar Surface Area:
151.98
HBA:
10
HBD:
4
#RO5 Violations:
2
#Rotatable Bonds:
34
Passes Ro3:
N
QED Weighted:
0.03
DETAILS
CLOSE
ALA5278396 Name:
N-(4-(imidazo[1,2-a]pyridin-3-yl)phenyl)-5-nitrofu
Show More⌵
Mol. Formula:
C18H12N4O4
M.W.:
348.32
Type:
---
AlogP:
3.75
Polar Surface Area:
102.68
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA5284687 Name:
5-nitro-N-(4-(7-(1,2,3,6-tetrahydropyridin-4-yl)im
Show More⌵
Mol. Formula:
C23H19N5O4
M.W.:
429.44
Type:
---
AlogP:
4.13
Polar Surface Area:
114.71
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA5290748 Name:
N-(4-(7-bromoimidazo[1,2-a]pyridin-3-yl)phenyl)-5-
Show More⌵
Mol. Formula:
C18H11BrN4O4
M.W.:
427.21
Type:
---
AlogP:
4.52
Polar Surface Area:
102.68
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA5290172 Name:
N-(4-(7-methoxyimidazo[1,2-a]pyridin-3-yl)-2-methy
Show More⌵
Mol. Formula:
C21H15F3N4O5
M.W.:
460.37
Type:
---
AlogP:
5.09
Polar Surface Area:
111.91
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5289129 Name:
N-(3-fluoro-4-(7-methoxyimidazo[1,2-a]pyridin-3-yl
Show More⌵
Mol. Formula:
C19H13FN4O5
M.W.:
396.33
Type:
---
AlogP:
3.90
Polar Surface Area:
111.91
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5288912 Name:
2,6-bis(4-(prop-2-yn-1-yloxy)benzylidene)cyclohexa
Show More⌵
Mol. Formula:
C26H22O3
M.W.:
382.46
Type:
---
AlogP:
4.93
Polar Surface Area:
35.53
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA5287932 Name:
N-(4-(7-methoxyimidazo[1,2-a]pyridin-3-yl)-2-methy
Show More⌵
Mol. Formula:
C20H16N4O5
M.W.:
392.37
Type:
---
AlogP:
4.07
Polar Surface Area:
111.91
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4467353 Name:
6-methoxy-3-(5-methoxy-1H-benzo[d]imidazol-2-yl)-2
Show More⌵
Mol. Formula:
C18H14N2O4
M.W.:
322.32
Type:
Unknown
AlogP:
3.35
Polar Surface Area:
77.35
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4096955 Name:
9-((1-benzyl-1H-1,2,3-triazol-4-yl)methoxy)-7H-fur
Show More⌵
Mol. Formula:
C21H15N3O4
M.W.:
373.37
Type:
Small molecule
AlogP:
3.76
Polar Surface Area:
83.29
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4095538 Name:
9-((1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl)meth
Show More⌵
Mol. Formula:
C21H15N3O5
M.W.:
389.37
Type:
Small molecule
AlogP:
3.71
Polar Surface Area:
92.52
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
Type:
Small molecule
AlogP:
2.19
Polar Surface Area:
71.77
HBA:
2
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.86
DETAILS
CLOSE
ALA4102680 Name:
1-(4-(trifluoromethyl)phenyl)-4-methyl-1H-1,2,3-tr
Show More⌵
Mol. Formula:
C10H8F3N3
M.W.:
227.19
Type:
Small molecule
AlogP:
2.59
Polar Surface Area:
30.71
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
Y
QED Weighted:
0.75
DETAILS
CLOSE
Shop By
Filters Level 1 ATC Code Description
Level 2 ATC Code Description