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ALA5272456 Name:
2-(3-Ethyl-[1,2,4]triazol-1-yl)-1-((S)-2-hydroxymethyl-4-[2-trifluoromethylShow More⌵
Mol. Formula:
C20H20F6N8O2S
M.W.:
550.49
Type:
---
AlogP:
2.50
Polar Surface Area:
113.16
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA5272415 Name:
2-(3-Ethyl-[1,2,4]triazol-1-yl)-1-((R)-2-(2-hydroxy-ethyl)-4-(2-trifluoromeShow More⌵
Mol. Formula:
C21H22F6N8O2S
M.W.:
564.52
Type:
---
AlogP:
2.89
Polar Surface Area:
113.16
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA5271738 Name:
1-(((7,7-dimethylbicyclo[2.2.1]heptan-1-yl)methyl)sulfonyl)-4-(5-(trifluoroShow More⌵
Mol. Formula:
C20H28F3N3O2S
M.W.:
431.52
Type:
---
AlogP:
3.77
Polar Surface Area:
53.51
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA5271415 Name:
1-((S)-2-Hydroxymethyl-4-[2-trifluoromethyl-4-(2-trifluoromethyl-pyrimidin-Show More⌵
Mol. Formula:
C21H22F6N8O2S
M.W.:
564.52
Type:
---
AlogP:
3.06
Polar Surface Area:
113.16
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA5271214 Name:
1-((R)-2-Hydroxymethyl-4-[2-trifluoromethyl-4-(2-trifluoromethyl-pyrimidin-Show More⌵
Mol. Formula:
C19H18F6N8O2S
M.W.:
536.46
Type:
---
AlogP:
2.25
Polar Surface Area:
113.16
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA5271152 Name:
1-((S)-2-(2-Hydroxy-ethyl)-4-[2-trifluoromethyl-4-(2-trifluoromethyl-pyrimiShow More⌵
Mol. Formula:
C21H21F6N7O2S
M.W.:
549.50
Type:
---
AlogP:
3.24
Polar Surface Area:
100.27
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA5270709 Name:
(6aR,9R)-N9,N9-diethyl-N7-phenyl-4,6,6a,8,9,10b-hexahydroindolo[4,3-fg]quinShow More⌵
Mol. Formula:
C26H30N4O2
M.W.:
430.55
Type:
---
AlogP:
4.09
Polar Surface Area:
68.44
HBA:
2
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA5269745 Name:
1-(2-((R)-2-Methyl-4-[2-trifluoromethyl-4-(2-trifluoromethyl-pyrimidin-5-ylShow More⌵
Mol. Formula:
C19H15F6N9OS
M.W.:
531.45
Type:
---
AlogP:
2.84
Polar Surface Area:
116.72
HBA:
10
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA5269005 Name:
1-((S)-2-(2-Hydroxy-ethyl)-4-[2-trifluoromethyl-4-(2-trifluoromethyl-pyrimiShow More⌵
Mol. Formula:
C22H24F6N8O2S
M.W.:
578.54
Type:
---
AlogP:
3.45
Polar Surface Area:
113.16
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA5268766 Name:
2-(5-Ethyl-[1,2,4]triazol-1-yl)-1-((R)-2-methyl-4-(2-trifiuoromethyl-4-(2-tShow More⌵
Mol. Formula:
C20H20F6N8OS
M.W.:
534.49
Type:
---
AlogP:
3.53
Polar Surface Area:
92.93
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA5268341 Name:
(2R,3R,4R)-2,3,4,5-tetrahydroxypentyl(4S,5S,8S,9S,12S,13R,14S,16S,18S)-13-(Show More⌵
Mol. Formula:
C42H74O15
M.W.:
819.04
Type:
---
AlogP:
1.93
Polar Surface Area:
253.13
HBA:
15
HBD:
9
#RO5 Violations:
3
#Rotatable Bonds:
24
Passes Ro3:
N
QED Weighted:
0.04
DETAILS
CLOSE
ALA5282225 Name:
1-((1R,3s,5S)-8-((9-acetyl-9-azabicyclo[3.3.1]non-2-en-3-yl)methyl)-8-azabiShow More⌵
Mol. Formula:
C26H32F4N4O2
M.W.:
508.56
Type:
---
AlogP:
5.06
Polar Surface Area:
64.68
HBA:
3
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA5282172 Name:
1-((R)-2-(2-Hydroxy-ethyl)-4-[2-trifluoromethyl-4-(2-trifluoromethyl-pyrimiShow More⌵
Mol. Formula:
C21H21F6N7O2S
M.W.:
549.50
Type:
---
AlogP:
3.24
Polar Surface Area:
100.27
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA5281798 Name:
2-(3-Ethyl-[1,2,4]triazol-1-yl)-1-((S)-2-(2-hydroxy-ethyl)-4-[2-trifluoromeShow More⌵
Mol. Formula:
C21H22F6N8O2S
M.W.:
564.52
Type:
---
AlogP:
2.89
Polar Surface Area:
113.16
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA5281745 Name:
2-(3-Cyclopropyl-[1,2,4]triazol-1-yl)-1-((S)-2-hydroxymethyl-4-[2-trifluoroShow More⌵
Mol. Formula:
C21H20F6N8O2S
M.W.:
562.50
Type:
---
AlogP:
2.82
Polar Surface Area:
113.16
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA5281022 Name:
1-(2-((R)-2-Methyl-4-(2-trifluoromethyl-4-(2-trifluoromethyl-pyrimidin-5-ylShow More⌵
Mol. Formula:
C19H17F6N9O2S
M.W.:
549.46
Type:
---
AlogP:
2.07
Polar Surface Area:
136.02
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA5281002 Name:
3-chloro-N-(5-chloro-2-(4-(2-(pyridin-3-ylamino)ethyl)piperidin-1-yl)pyridiShow More⌵
Mol. Formula:
C24H25Cl2N5O
M.W.:
470.40
Type:
---
AlogP:
5.75
Polar Surface Area:
70.15
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA5280406 Name:
2-(3-Ethyl-[1,2,4]triazol-4-yl)-1-((R)-2-methyl-4-(2-trifluoromethyl-4-(2-tShow More⌵
Mol. Formula:
C20H20F6N8OS
M.W.:
534.49
Type:
---
AlogP:
3.53
Polar Surface Area:
92.93
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA5279308 Name:
1-((R)-2-(2-Hydroxy-ethyl)-4-[2-trifluoromethyl-4-(2-trifluoromethyl-pyrimiShow More⌵
Mol. Formula:
C20H20F6N8O2S
M.W.:
550.49
Type:
---
AlogP:
2.64
Polar Surface Area:
113.16
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA5279193 Name:
2-(3-Ethyl-pyrazol-1-yl)-1-((R)-2-(2-hydroxy-ethyl)-4-[2-trifluoromethyl-4-Show More⌵
Mol. Formula:
C22H23F6N7O2S
M.W.:
563.53
Type:
---
AlogP:
3.50
Polar Surface Area:
100.27
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
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