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ALA5284623 Name:
N-(2-aminophenyl)-2-((6-((4-ethylpiperazin-1-yl)methyl)-2-methylpyrimidin-4Show More⌵
Mol. Formula:
C22H28N8OS
M.W.:
452.59
Type:
---
AlogP:
2.96
Polar Surface Area:
112.30
HBA:
9
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA5208315 Name:
(2S,4S)-N-(4-chloro-3-(trifluoromethyl)phenyl)-4-(4-(6-(methylsulfonamido)pShow More⌵
Mol. Formula:
C20H19ClF3N7O3S
M.W.:
529.93
Type:
---
AlogP:
2.93
Polar Surface Area:
130.90
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA5208081 Name:
5-(1-((3S,5S)-5-((4-chloro-3-(trifluoromethyl)phenyl)carbamoyl)pyrrolidin-3Show More⌵
Mol. Formula:
C24H25ClF3N7O2
M.W.:
535.96
Type:
---
AlogP:
4.04
Polar Surface Area:
105.04
HBA:
7
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA5207653 Name:
(2S,4S)-N-(4-bromophenyl)-4-(4-(2-(cyclopropanecarboxamido)thiazolo[5,4-b]pShow More⌵
Mol. Formula:
C23H21BrN8O2S
M.W.:
553.45
Type:
---
AlogP:
3.60
Polar Surface Area:
126.72
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5207617 Name:
(2S,4S)-4-(4-(2-aminothiazolo[5,4-b]pyridin-5-yl)-1H-1,2,3-triazol-1-yl)-N-Show More⌵
Mol. Formula:
C19H16Cl2N8OS
M.W.:
475.37
Type:
---
AlogP:
3.38
Polar Surface Area:
123.64
HBA:
9
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA5207090 Name:
tert-butyl (2S,4S)-4-(4-(2-aminothiazolo[5,4-b]pyridin-5-yl)-1H-1,2,3-triazShow More⌵
Mol. Formula:
C24H24F2N8O3S
M.W.:
542.57
Type:
---
AlogP:
4.00
Polar Surface Area:
141.15
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA5207040 Name:
(2S,4S)-4-(4-(3-acetamido-1H-indazol-6-yl)-1H-1,2,3-triazol-1-yl)-N-(2,4-diShow More⌵
Mol. Formula:
C22H20Cl2N8O2
M.W.:
499.36
Type:
---
AlogP:
3.63
Polar Surface Area:
129.62
HBA:
7
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5206184 Name:
(2S,4S)-4-(4-(2-acetamidothiazolo[5,4-b]pyridin-5-yl)-1H-1,2,3-triazol-1-ylShow More⌵
Mol. Formula:
C22H18ClF3N8O2S
M.W.:
550.95
Type:
---
AlogP:
4.12
Polar Surface Area:
126.72
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5203678 Name:
(2S,4S)-4-(4-(3-amino-1H-indazol-6-yl)-1H-1,2,3-triazol-1-yl)-N-(4-bromopheShow More⌵
Mol. Formula:
C20H19BrN8O
M.W.:
467.33
Type:
---
AlogP:
2.71
Polar Surface Area:
126.54
HBA:
7
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA5203239 Name:
(2S,4S)-4-(4-(6-aminopyridin-3-yl)-1H-1,2,3-triazol-1-yl)-N-(4-chloro-3-(trShow More⌵
Mol. Formula:
C19H17ClF3N7O
M.W.:
451.84
Type:
---
AlogP:
3.14
Polar Surface Area:
110.75
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA5203127 Name:
tert-butyl (2S,4S)-4-(4-(3-amino-1H-indazol-6-yl)-1H-1,2,3-triazol-1-yl)-2-Show More⌵
Mol. Formula:
C25H27BrN8O3
M.W.:
567.45
Type:
---
AlogP:
4.36
Polar Surface Area:
144.05
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5202743 Name:
(2S,4S)-N-(4-chloro-3-(trifluoromethyl)phenyl)-4-(4-(6-pivalamidopyridin-3-Show More⌵
Mol. Formula:
C24H25ClF3N7O2
M.W.:
535.96
Type:
---
AlogP:
4.54
Polar Surface Area:
113.83
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA5200499 Name:
(2S,4S)-4-(4-(3-(cyclopropanecarboxamido)-1H-indazol-6-yl)-1H-1,2,3-triazolShow More⌵
Mol. Formula:
C24H22Cl2N8O2
M.W.:
525.40
Type:
---
AlogP:
4.02
Polar Surface Area:
129.62
HBA:
7
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA5197019 Name:
(2S,4S)-4-(4-(3-acetamido-1H-indazol-6-yl)-1H-1,2,3-triazol-1-yl)-N-(4-bromShow More⌵
Mol. Formula:
C22H21BrN8O2
M.W.:
509.37
Type:
---
AlogP:
3.08
Polar Surface Area:
129.62
HBA:
7
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA5196757 Name:
(2S,4S)-4-(4-(2-acetamidothiazolo[5,4-b]pyridin-5-yl)-1H-1,2,3-triazol-1-ylShow More⌵
Mol. Formula:
C21H18F2N8O2S
M.W.:
484.49
Type:
---
AlogP:
2.73
Polar Surface Area:
126.72
HBA:
9
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5196374 Name:
tert-butyl (2S,4S)-4-(4-(2-aminothiazolo[5,4-b]pyridin-5-yl)-1H-1,2,3-triazShow More⌵
Mol. Formula:
C24H25BrN8O3S
M.W.:
585.49
Type:
---
AlogP:
4.48
Polar Surface Area:
141.15
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA5194721 Name:
(2S,4S)-4-(4-(2-(cyclopropanecarboxamido)thiazolo[5,4-b]pyridin-5-yl)-1H-1,Show More⌵
Mol. Formula:
C23H20F2N8O2S
M.W.:
510.53
Type:
---
AlogP:
3.12
Polar Surface Area:
126.72
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA5193797 Name:
tert-butyl (2S,4S)-4-(4-(3-amino-1H-indazol-6-yl)-1H-1,2,3-triazol-1-yl)-2-Show More⌵
Mol. Formula:
C25H26Cl2N8O3
M.W.:
557.44
Type:
---
AlogP:
4.90
Polar Surface Area:
144.05
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA5193726 Name:
(2S,4S)-4-(4-(6-acetamidopyridin-3-yl)-1H-1,2,3-triazol-1-yl)-N-(4-chloro-3Show More⌵
Mol. Formula:
C21H19ClF3N7O2
M.W.:
493.88
Type:
---
AlogP:
3.51
Polar Surface Area:
113.83
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA5193389 Name:
5-(1-(3S,5S)-5-((4-chloro-3-(trifluoromethyl)phenyl)carbamoyl)pyrrolidin-3-Show More⌵
Mol. Formula:
C23H21ClF3N7O2
M.W.:
519.92
Type:
---
AlogP:
3.45
Polar Surface Area:
113.83
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
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