The store will not work correctly when cookies are disabled.
Your company account is blocked and you cannot place orders. If you have questions, please contact your company administrator.
The page will load shortly, Thanks for your patience!
Select all
ALA5197135 Name:
(S)-2-amino-4-((((2S,3R,4S,5S)-5-(6-amino-9H-purin
Show More⌵
Mol. Formula:
C22H38N8O5
M.W.:
494.60
Type:
---
AlogP:
-0.70
Polar Surface Area:
197.90
HBA:
12
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
CLOSE
ALA5184605 Name:
Sinefugin
Mol. Formula:
C15H23N7O5
M.W.:
381.39
Type:
---
AlogP:
-2.06
Polar Surface Area:
208.65
HBA:
11
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA4648639 Name:
2-(4-isopropylphenyl)cyclohexa-2,5-diene-1,4-dione
Cas Number:
618395-11-2
Mol. Formula:
C15H14O2
M.W.:
226.28
Type:
Unknown
AlogP:
2.90
Polar Surface Area:
34.14
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
Y
QED Weighted:
0.73
DETAILS
CLOSE
ALA4648318 Name:
N-(5-(3,6-dioxocyclohexa-1,4-dienyl)-2-(pyrrolidin
Show More⌵
Mol. Formula:
C24H24N2O5S
M.W.:
452.53
Type:
Unknown
AlogP:
3.18
Polar Surface Area:
92.78
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4647903 Name:
N-(5-(3,6-dioxocyclohexa-1,4-dienyl)-2-(morpholino
Show More⌵
Mol. Formula:
C24H24N2O5S
M.W.:
452.53
Type:
Unknown
AlogP:
2.72
Polar Surface Area:
92.78
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4647178 Name:
4-chloro-N-(5-(3,6-dioxocyclohexa-1,4-dienyl)-2-(m
Show More⌵
Mol. Formula:
C23H21ClN2O5S
M.W.:
472.95
Type:
Unknown
AlogP:
3.06
Polar Surface Area:
92.78
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4646708 Name:
tert-butyl 4-(3'-cyanobiphenylcarbonyl)piperazine-
Show More⌵
Mol. Formula:
C23H25N3O3
M.W.:
391.47
Type:
Unknown
AlogP:
3.92
Polar Surface Area:
73.64
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA4645963 Name:
tert-butyl 4-(2-(4-chlorophenylsulfonamido)-4-(3,6
Show More⌵
Mol. Formula:
C28H30ClN3O6S
M.W.:
572.08
Type:
Unknown
AlogP:
4.28
Polar Surface Area:
113.09
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4645857 Name:
2',5'-dimethoxy-4-(pyrrolidin-1-ylmethyl)biphenyl-
Show More⌵
Mol. Formula:
C19H24N2O2
M.W.:
312.41
Type:
Unknown
AlogP:
3.55
Polar Surface Area:
47.72
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.86
DETAILS
CLOSE
ALA4645807 Name:
N-(5-(3,6-dioxocyclohexa-1,4-dienyl)-2-(morpholino
Show More⌵
Mol. Formula:
C23H21N3O7S
M.W.:
483.50
Type:
Unknown
AlogP:
2.32
Polar Surface Area:
135.92
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4645663 Name:
2,4,6-trichlorophenyl ethenesulfonate
Mol. Formula:
C8H5Cl3O3S
M.W.:
287.55
Type:
Unknown
AlogP:
3.50
Polar Surface Area:
43.37
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA4645328 Name:
2-(5-(piperazine-1-carbonyl)furan-2-yl)cyclohexa-2
Show More⌵
Mol. Formula:
C15H14N2O4
M.W.:
286.29
Type:
Unknown
AlogP:
0.42
Polar Surface Area:
79.62
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA4644194 Name:
tert-butyl 4-(4'-cyanobiphenylcarbonyl)piperazine-
Show More⌵
Mol. Formula:
C23H25N3O3
M.W.:
391.47
Type:
Unknown
AlogP:
3.92
Polar Surface Area:
73.64
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA4642804 Name:
2-(4-bromophenyl)cyclohexa-2,5-diene-1,4-dione
Cas Number:
30100-33-5
Mol. Formula:
C12H7BrO2
M.W.:
263.09
Type:
Unknown
AlogP:
2.54
Polar Surface Area:
34.14
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
Y
QED Weighted:
0.73
DETAILS
CLOSE
ALA4642542 Name:
1-((2',5'-dimethoxy-3-nitrobiphenyl-4-yl)methyl)py
Show More⌵
Mol. Formula:
C19H22N2O4
M.W.:
342.40
Type:
Unknown
AlogP:
3.87
Polar Surface Area:
64.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4642263 Name:
tert-butyl 4-(4-(3,6-dioxocyclohexa-1,4-dienyl)ben
Show More⌵
Mol. Formula:
C23H26N2O5
M.W.:
410.47
Type:
Unknown
AlogP:
2.86
Polar Surface Area:
83.99
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
ALA4641837 Name:
tert-butyl 4-((3-amino-2',5'-dimethoxybiphenyl-4-y
Show More⌵
Mol. Formula:
C24H33N3O4
M.W.:
427.55
Type:
Unknown
AlogP:
4.01
Polar Surface Area:
77.26
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA4641699 Name:
tert-butyl 4-((2',5'-dimethoxybiphenyl-4-yl)methyl
Show More⌵
Mol. Formula:
C24H32N2O4
M.W.:
412.53
Type:
Unknown
AlogP:
4.42
Polar Surface Area:
51.24
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA4641673 Name:
N-(5-(3,6-dioxocyclohexa-1,4-dienyl)-2-(pyrrolidin
Show More⌵
Mol. Formula:
C21H26N2O4S
M.W.:
402.52
Type:
Unknown
AlogP:
2.92
Polar Surface Area:
83.55
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4641533 Name:
N-(5-(3,6-dioxocyclohexa-1,4-dienyl)-2-(pyrrolidin
Show More⌵
Mol. Formula:
C24H21F3N2O4S
M.W.:
490.50
Type:
Unknown
AlogP:
4.19
Polar Surface Area:
83.55
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
Shop By
Filters Level 1 ATC Code Description
Level 2 ATC Code Description