The store will not work correctly when cookies are disabled.
The page will load shortly, Thanks for your patience!
Select all
ALA5276737 Name:
(2S)-2-[(2S,3R)-2-{[(7R,10S,13S,16S,19S,22S,25S)-2
Show More⌵
Mol. Formula:
C70H100N14O25S3
M.W.:
1633.84
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5185285 Name:
(3S)-3-[[(2S,3R)-2-[[(3S,6S,9S,12S,15S,18S,21R)-3-
Show More⌵
Mol. Formula:
C63H95N15O27S3
M.W.:
1590.73
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA2160035 Name:
3-Chloro-6-fluoro-N-[trans-4-(methylamino)cyclohex
Show More⌵
Mol. Formula:
C28H27ClFN3OS
M.W.:
508.06
Type:
Small molecule
AlogP:
6.93
Polar Surface Area:
45.23
HBA:
4
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA2160033 Name:
3-Chloro-N-[cis-4-(methylamino)cyclohexyl]-N-(3-py
Show More⌵
Mol. Formula:
C28H28ClN3OS
M.W.:
490.07
Type:
Small molecule
AlogP:
6.79
Polar Surface Area:
45.23
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA2160031 Name:
3,4-Dichloro-N-[trans-4-(methylamino)cyclohexyl]-N
Show More⌵
Mol. Formula:
C28H27Cl2N3OS
M.W.:
524.52
Type:
Small molecule
AlogP:
7.44
Polar Surface Area:
45.23
HBA:
4
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA1213326 Name:
2-((3S,6S,12S,E)-12-amino-3-methyl-5,13-dioxo-1-ox
Show More⌵
Cas Number:
1132653-86-1
Mol. Formula:
C23H33N3O5
M.W.:
431.53
Type:
Small molecule
AlogP:
1.13
Polar Surface Area:
121.96
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA1080091 Name:
(S,E)-N-(4-chlorobenzyl)-2-(5,12-dioxo-1-oxa-4-aza
Show More⌵
Mol. Formula:
C19H23ClN2O4
M.W.:
378.86
Type:
Small molecule
AlogP:
2.36
Polar Surface Area:
84.50
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA1080988 Name:
(R,E)-N-(4-chlorobenzyl)-2-(5,12-dioxo-1-oxa-4-aza
Show More⌵
Mol. Formula:
C19H23ClN2O4
M.W.:
378.86
Type:
Small molecule
AlogP:
2.36
Polar Surface Area:
84.50
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA480889 Name:
N-((3S,5S)-1-(benzo[d][1,3]dioxol-5-ylmethyl)-5-(p
Show More⌵
Cas Number:
334998-36-6
Mol. Formula:
C31H42N4O5
M.W.:
550.70
Type:
Small molecule
AlogP:
3.26
Polar Surface Area:
83.58
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
Type:
Small molecule
AlogP:
4.10
Polar Surface Area:
84.50
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA515092 Name:
N-(1-(benzo[d][1,3]dioxol-5-ylmethyl)-5-(piperazin
Show More⌵
Cas Number:
334998-39-9
Mol. Formula:
C29H38N4O5
M.W.:
522.65
Type:
Small molecule
AlogP:
2.48
Polar Surface Area:
83.58
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA473189 Name:
N-(1-(benzo[d][1,3]dioxol-5-ylmethyl)-5-(piperazin
Show More⌵
Mol. Formula:
C29H36N4O5
M.W.:
520.63
Type:
Small molecule
AlogP:
2.24
Polar Surface Area:
83.58
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
Shop By
Filters Level 1 ATC Code Description
Level 2 ATC Code Description