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ALA5269225 Name:
(S)-N-(6-(indolin-1-yl)-6-oxohex-4-en-3-yl)-4-methyltetrahydro-2H-pyran-4-cShow More⌵
Mol. Formula:
C21H28N2O3
M.W.:
356.47
Type:
---
AlogP:
2.84
Polar Surface Area:
58.64
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA5290773 Name:
(R)-4-((2S,3R)-2-amino-3-hydroxybutanamido)-6-(methylsulfonyl)hex-5-enoic aShow More⌵
Mol. Formula:
C11H20N2O6S
M.W.:
308.36
Type:
---
AlogP:
-1.40
Polar Surface Area:
146.79
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA5196138 Name:
tert-butyl (4-((5-chloro-2-((5-(thiophen-3-yl)pyridin-2-yl)amino)pyrimidin-Show More⌵
Mol. Formula:
C19H15ClN6S
M.W.:
394.89
Type:
---
AlogP:
5.32
Polar Surface Area:
88.75
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5208614 Name:
5-chloro-N2-(3-nitro-5-(thiophen-3-yl)pyridin-2-yl)-N4-(3-(trifluoromethyl)Show More⌵
Mol. Formula:
C20H12ClF3N6O2S
M.W.:
492.87
Type:
---
AlogP:
6.67
Polar Surface Area:
105.87
HBA:
8
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA5208509 Name:
3-(2-((5-(thiophen-3-yl)pyridin-2-yl)amino)-4-((3-(trifluoromethyl)phenyl)aShow More⌵
Mol. Formula:
C27H19F3N6OS
M.W.:
532.55
Type:
---
AlogP:
6.87
Polar Surface Area:
105.82
HBA:
7
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA5207778 Name:
N-(4-(2-((5-(thiophen-3-yl)pyridin-2-yl)amino)-4-((3-(trifluoromethyl)phenyShow More⌵
Mol. Formula:
C28H21F3N6OS
M.W.:
546.58
Type:
---
AlogP:
7.73
Polar Surface Area:
91.83
HBA:
7
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA5206777 Name:
5-(4-chlorophenYl)-N2-(5-(thiophen-3-yl)pyridin-2-Yl)-N4-(3-(trifluoromethyShow More⌵
Mol. Formula:
C26H17ClF3N5S
M.W.:
523.97
Type:
---
AlogP:
8.43
Polar Surface Area:
62.73
HBA:
6
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA5206614 Name:
5-bromo-N2-(5-(thiophen-3-yl)pyridin-2-yl)-N4-(3-(trifluoromethyl)phenyl)pyShow More⌵
Mol. Formula:
C20H13BrF3N5S
M.W.:
492.32
Type:
---
AlogP:
6.87
Polar Surface Area:
62.73
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA5205065 Name:
5-chloro-N2-(4-(thiophen-3-yl)pyridin-2-yl)-N4-(3-(trifluoromethyl)phenyl)pShow More⌵
Mol. Formula:
C20H13ClF3N5S
M.W.:
447.87
Type:
---
AlogP:
6.76
Polar Surface Area:
62.73
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA5204393 Name:
5-chloro-N2-(5-(thiophen-3-yl)pyridin-2-yl)-N4-(4-(trifluoromethyl)benzyl)pShow More⌵
Mol. Formula:
C21H15ClF3N5S
M.W.:
461.90
Type:
---
AlogP:
6.63
Polar Surface Area:
62.73
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5202703 Name:
N-(3-(2-((5-(thiophen-3-yl)pyridin-2-yl)amino)-4-((3-(trifluommethyl)phenylShow More⌵
Mol. Formula:
C28H21F3N6OS
M.W.:
546.58
Type:
---
AlogP:
7.73
Polar Surface Area:
91.83
HBA:
7
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA5202532 Name:
5-chloro-N2-(5-(thiophen-3-yl)pyridin-2-yl)-N4-(4-(trifluoromethyl)phenyl)pShow More⌵
Mol. Formula:
C20H13ClF3N5S
M.W.:
447.87
Type:
---
AlogP:
6.76
Polar Surface Area:
62.73
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA5201740 Name:
N-(4-((5-chloro-2-((5-(thiophen-3-yl)pyridin-2-yl)amino)pyrimidin-4-yl)aminShow More⌵
Mol. Formula:
C21H17ClN6OS
M.W.:
436.93
Type:
---
AlogP:
5.70
Polar Surface Area:
91.83
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA5200608 Name:
5-chloro-N4-(3,4-difluorophenyl)-N2-(5-(thiophen-3-yl)pyridin-2-yl)pyrimidiShow More⌵
Mol. Formula:
C19H12ClF2N5S
M.W.:
415.86
Type:
---
AlogP:
6.02
Polar Surface Area:
62.73
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA5198638 Name:
5-chloro-N2-(6-(thiophen-3-yl)pyridazin-3-yl)-N1-(3-(trifluoromethyl)phenylShow More⌵
Mol. Formula:
C19H12ClF3N6S
M.W.:
448.86
Type:
---
AlogP:
6.15
Polar Surface Area:
75.62
HBA:
7
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA5198107 Name:
5-(4-(4-methylpiperazin-1-yl)phenyl)-N2-(5-(thiophen-3-Yl)pyridin-2-yl)-N4-Show More⌵
Mol. Formula:
C31H28F3N7S
M.W.:
587.67
Type:
---
AlogP:
7.52
Polar Surface Area:
69.21
HBA:
8
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA5195835 Name:
5-(1-methyl-1,2,3,6-tetrahydropyridin-4-yl)-N2-(5-(thiophen-3-yl)pyridin-2-Show More⌵
Mol. Formula:
C26H23F3N6S
M.W.:
508.57
Type:
---
AlogP:
6.83
Polar Surface Area:
65.97
HBA:
7
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA5191730 Name:
5-chloro-N2-(4-(thiophen-3-yl)phenyl)-N4-(3-(trifluoromethyl)phenyl)pyrimidShow More⌵
Mol. Formula:
C21H14ClF3N4S
M.W.:
446.89
Type:
---
AlogP:
7.36
Polar Surface Area:
49.84
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5189882 Name:
5-chloro-N2-(3-(thiophen-3-yl)phenyl)-N3-(3-(trifluoromethyl)phenyl)pyrimidShow More⌵
Mol. Formula:
C21H14ClF3N4S
M.W.:
446.89
Type:
---
AlogP:
7.36
Polar Surface Area:
49.84
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5189518 Name:
5-phenyl-N2-(5-(thiophen-3-yl)pyridin-2-yl)-N4-(3-(trifluoromethyl)phenyl)pShow More⌵
Mol. Formula:
C26H18F3N5S
M.W.:
489.53
Type:
---
AlogP:
7.77
Polar Surface Area:
62.73
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
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