The store will not work correctly when cookies are disabled.
The page will load shortly, Thanks for your patience!
Select all
ALA5219557 Name:
4-[7-(diethylamino)-2-imino-chromen-3-yl]-6-(4-phenylpiperazin-1-yl)-1,3,5-Show More⌵
Mol. Formula:
C26H30N8O
M.W.:
470.58
Type:
---
AlogP:
3.52
Polar Surface Area:
111.40
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4878409 Name:
5-bromo-4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[1-[(dimethylamino)methShow More⌵
Mol. Formula:
C30H35BrF2N6O2
M.W.:
629.55
Type:
Unknown
AlogP:
4.57
Polar Surface Area:
76.99
HBA:
8
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4876274 Name:
4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[1-[[(3R)-3-fluoropyrrolidin-1-Show More⌵
Mol. Formula:
C32H38FIN6O2
M.W.:
684.60
Type:
Unknown
AlogP:
4.65
Polar Surface Area:
76.99
HBA:
8
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4875572 Name:
5-bromo-4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[1-[[(3R)-3-fluoropyrroShow More⌵
Mol. Formula:
C32H38BrFN6O2
M.W.:
637.60
Type:
Unknown
AlogP:
4.80
Polar Surface Area:
76.99
HBA:
8
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4872714 Name:
5-bromo-4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[1-(morpholinomethyl)cyShow More⌵
Mol. Formula:
C32H39BrN6O3
M.W.:
635.61
Type:
Unknown
AlogP:
4.09
Polar Surface Area:
86.22
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4869200 Name:
4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[1-(morpholinomethyl)cyclopropyShow More⌵
Mol. Formula:
C32H39IN6O3
M.W.:
682.61
Type:
Unknown
AlogP:
3.93
Polar Surface Area:
86.22
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4857517 Name:
4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[1-(morpholinomethyl)cyclopropyShow More⌵
Mol. Formula:
C33H42N6O3
M.W.:
570.74
Type:
Unknown
AlogP:
3.64
Polar Surface Area:
86.22
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4853619 Name:
5-bromo-4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[(2S,4R)-4-fluoro-1-metShow More⌵
Mol. Formula:
C29H34BrFN6O2
M.W.:
597.53
Type:
Unknown
AlogP:
4.02
Polar Surface Area:
76.99
HBA:
8
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4852554 Name:
4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[1-[(dimethylamino)methyl]cycloShow More⌵
Mol. Formula:
C31H33F2N5O2
M.W.:
545.63
Type:
Unknown
AlogP:
5.10
Polar Surface Area:
73.75
HBA:
7
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA4849611 Name:
4-[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[[1-[(dimethylamino)methyl]cycloShow More⌵
Mol. Formula:
C30H37IN6O2
M.W.:
640.57
Type:
Unknown
AlogP:
4.16
Polar Surface Area:
76.99
HBA:
8
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA3347687 Name:
4-(bis(2-methoxyethyl)amino)-7H-pyrido[4,3,2-de][1,7]phenanthrolin-7-one
Mol. Formula:
C20H20N4O3
M.W.:
364.41
Type:
Small molecule
AlogP:
2.34
Polar Surface Area:
77.44
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA3347506 Name:
4-(piperidin-1-yl)-7H-pyrido[4,3,2-de][1,7]phenanthrolin-7-one
Mol. Formula:
C19H16N4O
M.W.:
316.36
Type:
Small molecule
AlogP:
3.23
Polar Surface Area:
58.98
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA84 Name:
10-Dimethylaminomethyl-4-ethyl-4,9-dihydroxy-1,12-dihydro-4H-2-oxa-6,12a-diShow More⌵
Mol. Formula:
C23H23N3O5
M.W.:
421.45
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
Small molecule
AlogP:
1.85
Polar Surface Area:
104.89
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
Shop By
Filters Level 1 ATC Code Description
Level 2 ATC Code Description