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ALA5280124 Name:
Mol. Formula:
C69H86ClFN6O21
M.W.:
1389.92
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Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4800440 Name:
(2-Butyl-7-methyl-1,1-dioxo-2,3-dihydro-1H-1lambda6-benzo[d]isothiazol-3-ylShow More⌵
Mol. Formula:
C18H27NO4S
M.W.:
353.48
Type:
Unknown
AlogP:
3.57
Polar Surface Area:
63.68
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4799460 Name:
Butyl 2-(5-fluoro-7-methyl-1,1-dioxido-2-(4-(trifluoromethyl)benzoyl)-2,3-dShow More⌵
Mol. Formula:
C22H21F4NO5S
M.W.:
487.47
Type:
Unknown
AlogP:
4.77
Polar Surface Area:
80.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4798678 Name:
Butyl 2-(5,7-dimethoxy-1,1-dioxido-2-(4-(trifluoromethyl)benzoyl)-2,3-dihydShow More⌵
Mol. Formula:
C23H24F3NO7S
M.W.:
515.51
Type:
Unknown
AlogP:
4.34
Polar Surface Area:
99.21
HBA:
7
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4798677 Name:
Butyl (E)-3-(2-(3-(3-chloro-5-fluorophenyl)acryloyl)-7-methyl-1,1-dioxido-2Show More⌵
Mol. Formula:
C23H23ClFNO5S
M.W.:
479.96
Type:
Unknown
AlogP:
4.81
Polar Surface Area:
80.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4798492 Name:
(2,7-Dimethyl-1,1-dioxo-2,3-dihydro-1H-1lambda-6-benzo[d]isothiazol-3-yl)-aShow More⌵
Mol. Formula:
C15H21NO4S
M.W.:
311.40
Type:
Unknown
AlogP:
2.40
Polar Surface Area:
63.68
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA4798316 Name:
Tert-butyl 2-(7-methyl-1,1-dioxido-2-(4-(trifluoromethyl)benzoyl)-2,3-dihydShow More⌵
Mol. Formula:
C22H22F3NO5S
M.W.:
469.48
Type:
Unknown
AlogP:
4.63
Polar Surface Area:
80.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4798234 Name:
Methyl 2-(6-(3-(dimethylamino)phenoxy)-7-(4-(4-fluorophenoxy)butanamido)-4-Show More⌵
Mol. Formula:
C29H29FN4O6
M.W.:
548.57
Type:
Unknown
AlogP:
4.36
Polar Surface Area:
111.99
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA4797211 Name:
(7-Methyl-1,1-dioxo-2,3-dihydro-1H-1lambda-6-benzo[d]isothiazol-3-yl)-acetiShow More⌵
Mol. Formula:
C14H19NO4S
M.W.:
297.38
Type:
Unknown
AlogP:
2.06
Polar Surface Area:
72.47
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA4797120 Name:
2-(7-methyl-1,1-dioxido-2-(4-(trifluoromethyl)benzoyl)-2,3-dihydrobenzo[d]iShow More⌵
Mol. Formula:
C24H19F3N2O4S
M.W.:
488.49
Type:
Unknown
AlogP:
4.93
Polar Surface Area:
83.55
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA4796695 Name:
N-(6-(3-morpholinophenoxy)-4-oxo-3,4-dihydroquinazolin-7-yl)-4-(4-(trifluorShow More⌵
Mol. Formula:
C29H27F3N4O5
M.W.:
568.55
Type:
Unknown
AlogP:
5.37
Polar Surface Area:
105.78
HBA:
7
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4795977 Name:
[7-Methyl-1,1-dioxo-2-(4-trifluoromethyl-benzoyl)-2,3-dihydro-1H-1lambda-6-Show More⌵
Mol. Formula:
C22H22F3NO5S
M.W.:
469.48
Type:
Unknown
AlogP:
4.63
Polar Surface Area:
80.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4795936 Name:
Methyl 2-(6-(3-fluorophenyl)-4-oxo-7-((2-((4-(trifluoromethyl)benzyl)oxy)etShow More⌵
Mol. Formula:
C28H23F4N3O5
M.W.:
557.50
Type:
Unknown
AlogP:
4.34
Polar Surface Area:
99.52
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA4795643 Name:
(2-Ethyl-7-methyl-1,1-dioxo-2,3-dihydro-1H-1lambda6-benzo[d]isothiazol-3-ylShow More⌵
Mol. Formula:
C16H23NO4S
M.W.:
325.43
Type:
Unknown
AlogP:
2.79
Polar Surface Area:
63.68
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA4794543 Name:
(2-Acetyl-7-methyl-1,1-dioxo-2,3-dihydro-1H-1lambda-6-benzo[d]isothiazol-3-Show More⌵
Mol. Formula:
C16H21NO5S
M.W.:
339.41
Type:
Unknown
AlogP:
2.32
Polar Surface Area:
80.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4794272 Name:
Methyl 2-(6-(3-(dimethylamino)phenoxy)-4-oxo-7-(2-((4-(trifluoromethyl)benzShow More⌵
Mol. Formula:
C29H27F3N4O6
M.W.:
584.55
Type:
Unknown
AlogP:
4.60
Polar Surface Area:
111.99
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.27
DETAILS
CLOSE
ALA4793780 Name:
Butyl 3-(2-acryloyl-7-methyl-1,1-dioxido-2,3-dihydrobenzo[d]isothiazol-3-ylShow More⌵
Mol. Formula:
C17H21NO5S
M.W.:
351.42
Type:
Unknown
AlogP:
2.49
Polar Surface Area:
80.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA4793484 Name:
N-butyl-2-(7-methyl-1,1-dioxido-2-(4-(trifluoromethyl)benzoyl)-2,3-dihydrobShow More⌵
Mol. Formula:
C22H23F3N2O4S
M.W.:
468.50
Type:
Unknown
AlogP:
4.21
Polar Surface Area:
83.55
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4793354 Name:
Butyl 2-(4-fluoro-7-methyl-1,1-dioxido-2-(4-(trifluoromethyl)benzoyl)-2,3-dShow More⌵
Mol. Formula:
C22H21F4NO5S
M.W.:
487.47
Type:
Unknown
AlogP:
4.77
Polar Surface Area:
80.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4792710 Name:
Butyl 2-(5,7-dimethyl-1,1-dioxido-2-(4-(trifluoromethyl)benzoyl)-2,3-dihydrShow More⌵
Mol. Formula:
C23H24F3NO5S
M.W.:
483.51
Type:
Unknown
AlogP:
4.94
Polar Surface Area:
80.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
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