The store will not work correctly when cookies are disabled.
The page will load shortly, Thanks for your patience!
Select all
ALA5285687 Name:
N1-(((3aR,4R,6R,6aR)-6-methoxy-2,2-dimethyltetrahy
Show More⌵
Mol. Formula:
C32H49N3O4
M.W.:
539.76
Type:
---
AlogP:
6.13
Polar Surface Area:
73.87
HBA:
7
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA5282048 Name:
(3aR,5S,6R,6aR)-2,2-dimethyl-5-((7-((1,2,3,4-tetra
Show More⌵
Mol. Formula:
C27H39N3O4
M.W.:
469.63
Type:
---
AlogP:
4.26
Polar Surface Area:
84.87
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA5280820 Name:
1-ethyl-3-(6-(5-((prop-2-yn-1-ylamino)methyl)-1H-b
Show More⌵
Mol. Formula:
C18H19N7S
M.W.:
365.47
Type:
---
AlogP:
1.84
Polar Surface Area:
79.69
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA5288285 Name:
(3aR,5R,6S,6aR)-2,2-dimethyl-5-(((11-((1,2,3,4-tet
Show More⌵
Mol. Formula:
C32H49N3O4
M.W.:
539.76
Type:
---
AlogP:
5.86
Polar Surface Area:
84.87
HBA:
7
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA1097650 Name:
ethyl cyano-N,N-dimethylphosphonamidate
Mol. Formula:
C5H11N2O2P
M.W.:
162.13
Type:
Small molecule
AlogP:
1.26
Polar Surface Area:
53.33
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.59
DETAILS
CLOSE
ALA4548035 Name:
(R)-2-methyl-1-(2-(4-nitrophenoxy)ethyl)-2,3-dihyd
Show More⌵
Mol. Formula:
C22H26ClN3O5
M.W.:
447.92
Type:
Unknown
AlogP:
4.12
Polar Surface Area:
85.15
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA4555824 Name:
3-(4-hydroxyphenyl)-7-(4-(piperidin-1-yl)butoxy)-4
Show More⌵
Mol. Formula:
C24H28BrNO4
M.W.:
474.40
Type:
Unknown
AlogP:
4.81
Polar Surface Area:
62.91
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4541277 Name:
N1-(6-Deoxy-1,2:3,4-di-O-isopropylidene-alpha-D-ga
Show More⌵
Mol. Formula:
C40H49N3O5
M.W.:
651.85
Type:
Unknown
AlogP:
7.82
Polar Surface Area:
76.00
HBA:
8
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA5272055 Name:
N1-(1,2,3,4-tetrahydroacridin-9-yl)-N10-(((3aR,5R,
Show More⌵
Mol. Formula:
C35H53N3O5
M.W.:
595.83
Type:
---
AlogP:
6.63
Polar Surface Area:
83.10
HBA:
8
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
14
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA5209880 Name:
(E)-1-benzyl-4(2-((3,4-dimethoxyphenyl)sulfonyl)vi
Show More⌵
Mol. Formula:
C22H27NO4S
M.W.:
401.53
Type:
---
AlogP:
3.90
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
ALA5208030 Name:
(Z)-1-benzyl-4(2-chloro-2-((3,4-dimethoxyphenyl)su
Show More⌵
Mol. Formula:
C22H26ClNO4S
M.W.:
435.97
Type:
---
AlogP:
4.47
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA5206971 Name:
2-((4-Fluoro-1-(2-chlorobenzyl)piperidin-4-yl)meth
Show More⌵
Mol. Formula:
C23H27ClFNO4S
M.W.:
467.99
Type:
---
AlogP:
4.45
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA5205085 Name:
2-((1-(3-Chloro-4-fluorobenzyl)-4-fluoropiperidin-
Show More⌵
Mol. Formula:
C23H26ClF2NO4S
M.W.:
485.98
Type:
---
AlogP:
4.59
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA5204649 Name:
2-((1-Benzyl-4-fluoropiperidin-4-yl)methyl)-5,6-di
Show More⌵
Mol. Formula:
C23H28FNO4S
M.W.:
433.55
Type:
---
AlogP:
3.80
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA5204001 Name:
2-((1-(2,4-difluorobenzyl)-4-fluoropiperidin-4-yl)
Show More⌵
Mol. Formula:
C23H26F3NO4S
M.W.:
469.53
Type:
---
AlogP:
4.07
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA5202413 Name:
2-((1-benzylpiperidin-4-yl)methyl)-5,6-dimethoxy-2
Show More⌵
Mol. Formula:
C23H29NO4S
M.W.:
415.56
Type:
---
AlogP:
3.70
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA5201084 Name:
2-((4-Fluoro-1-(4-fluorobenzyl)piperidin-4-yl)meth
Show More⌵
Mol. Formula:
C23H27F2NO4S
M.W.:
451.54
Type:
---
AlogP:
3.94
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA5200196 Name:
(E)-2-((1-benzylpiperidin-4-yl)methylene)-5,6-dime
Show More⌵
Mol. Formula:
C23H27NO4S
M.W.:
413.54
Type:
---
AlogP:
3.83
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA5199752 Name:
2-((4-Fluoro-1-(2-fluorobenzyl)piperidin-4-yl)meth
Show More⌵
Mol. Formula:
C23H27F2NO4S
M.W.:
451.54
Type:
---
AlogP:
3.94
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA5199093 Name:
(E)-2-((1-benzylpiperidin-4-yl)methylene)-7,8-dime
Show More⌵
Mol. Formula:
C25H31NO4S
M.W.:
441.59
Type:
---
AlogP:
4.61
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
Shop By
Filters Level 1 ATC Code Description
Level 2 ATC Code Description