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ALA5268707 Name:
5-(4-(2-((2-(4-fluorobenzyl)-1,3-dioxoisoindolin-5-yl)amino)-2-oxoethyl)pheShow More⌵
Mol. Formula:
C28H25FN2O6
M.W.:
504.51
Type:
---
AlogP:
4.44
Polar Surface Area:
113.01
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA5278446 Name:
(S)-1,1'-(3-(4-bromophenyl)-7-methyl-5-oxo-[1,2,4]triazolo[4,3-a]pyrimidineShow More⌵
Mol. Formula:
C16H15BrN4O3
M.W.:
391.23
Type:
---
AlogP:
1.99
Polar Surface Area:
75.51
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA5219954 Name:
2-((3,3'-difluoro-4'-(piperazin-1-ylsulfonyl)biphenyl-4-yl)methylthio)-6,7-Show More⌵
Mol. Formula:
C24H24F2N4O3S2
M.W.:
518.61
Type:
---
AlogP:
3.09
Polar Surface Area:
95.16
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA5219938 Name:
N-(azetidin-3-yl)-3'-fluoro-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pShow More⌵
Mol. Formula:
C23H23FN4O3S2
M.W.:
486.59
Type:
---
AlogP:
2.61
Polar Surface Area:
103.95
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA5219911 Name:
1-(3'-fluoro-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-ylthShow More⌵
Mol. Formula:
C26H26FN3O5S2
M.W.:
543.64
Type:
---
AlogP:
3.84
Polar Surface Area:
120.43
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5219868 Name:
2-((3-fluoro-4'-(piperazin-1-ylsulfonyl)biphenyl-4-yl)methylthio)-6,7-dihydShow More⌵
Mol. Formula:
C24H25FN4O3S2
M.W.:
500.62
Type:
---
AlogP:
2.95
Polar Surface Area:
95.16
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5219839 Name:
N-((1S,2R)-2-aminocyclohexyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[dShow More⌵
Mol. Formula:
C26H30N4O3S2
M.W.:
510.69
Type:
---
AlogP:
3.77
Polar Surface Area:
117.94
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5219770 Name:
N-((1R,2R)-2-hydroxycyclohexyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopentaShow More⌵
Mol. Formula:
C26H29N3O4S2
M.W.:
511.67
Type:
---
AlogP:
3.80
Polar Surface Area:
112.15
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5219625 Name:
2-[[4-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]phenyl]-2-fluoro-phenyl]meShow More⌵
Mol. Formula:
C24H24FN3O5S3
M.W.:
549.67
Type:
---
AlogP:
2.78
Polar Surface Area:
117.27
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA5219537 Name:
N-cyclopropyl-3'-fluoro-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimShow More⌵
Mol. Formula:
C23H22FN3O3S2
M.W.:
471.58
Type:
---
AlogP:
3.80
Polar Surface Area:
91.92
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5219437 Name:
N-(2-(dimethylamino)ethyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyShow More⌵
Mol. Formula:
C24H28N4O3S2
M.W.:
484.65
Type:
---
AlogP:
3.06
Polar Surface Area:
95.16
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA5219410 Name:
2-((3-fluoro-4'-(morpholinosulfonyl)biphenyl-4-yl)methylthio)-6,7-dihydro-3Show More⌵
Mol. Formula:
C24H24FN3O4S2
M.W.:
501.61
Type:
---
AlogP:
3.38
Polar Surface Area:
92.36
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA5220923 Name:
N-(azetidin-3-yl)-3,3'-difluoro-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopentaShow More⌵
Mol. Formula:
C23H22F2N4O3S2
M.W.:
504.58
Type:
---
AlogP:
2.75
Polar Surface Area:
103.95
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5220881 Name:
N-(3-(methylamino)propyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrShow More⌵
Mol. Formula:
C24H28N4O3S2
M.W.:
484.65
Type:
---
AlogP:
3.11
Polar Surface Area:
103.95
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA5220833 Name:
N-(3-aminocyclohexyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidShow More⌵
Mol. Formula:
C26H30N4O3S2
M.W.:
510.69
Type:
---
AlogP:
3.77
Polar Surface Area:
117.94
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5220816 Name:
N-((1S,2S)-2-aminocyclohexyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[dShow More⌵
Mol. Formula:
C26H30N4O3S2
M.W.:
510.69
Type:
---
AlogP:
3.77
Polar Surface Area:
117.94
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5220661 Name:
N-(2-aminopropyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2Show More⌵
Mol. Formula:
C23H26N4O3S2
M.W.:
470.62
Type:
---
AlogP:
2.84
Polar Surface Area:
117.94
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5220605 Name:
2-[[4-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-3-fluoro-phenyl]-2-fluoroShow More⌵
Mol. Formula:
C24H23F2N3O5S3
M.W.:
567.66
Type:
---
AlogP:
2.92
Polar Surface Area:
117.27
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA5220533 Name:
N-(3-aminopropyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2Show More⌵
Mol. Formula:
C23H26N4O3S2
M.W.:
470.62
Type:
---
AlogP:
2.85
Polar Surface Area:
117.94
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA5220395 Name:
N-((1S,2S)-2-hydroxycyclohexyl)-4'-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopentaShow More⌵
Mol. Formula:
C26H29N3O4S2
M.W.:
511.67
Type:
---
AlogP:
3.80
Polar Surface Area:
112.15
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
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