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ALA4866753 Name:
N-(6-(4-methylpyridin-3-yl)benzo[d]thiazol-2-yl)be
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Mol. Formula:
C20H17Cl2N3OS
M.W.:
418.35
Type:
Unknown
AlogP:
4.92
Polar Surface Area:
54.88
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4547030 Name:
N2-((1r,4r)-4-aminocyclohexyl)-9-cyclopentyl-N6-(6
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Mol. Formula:
C25H30N8O
M.W.:
458.57
Type:
Unknown
AlogP:
5.02
Polar Surface Area:
119.71
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4847460 Name:
4-(4-(1-(2-(dimethylamino)ethyl)-5-(4-fluorophenyl
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Mol. Formula:
C28H29FN6O3S
M.W.:
548.64
Type:
Unknown
AlogP:
4.77
Polar Surface Area:
101.38
HBA:
8
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA4550659 Name:
3-(2-(((1r,4r)-4-aminocyclohexyl)amino)-6-((4-(4-b
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Mol. Formula:
C33H43N9O
M.W.:
581.77
Type:
Unknown
AlogP:
4.66
Polar Surface Area:
120.39
HBA:
10
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA4525165 Name:
4-((9-(3-hydroxypropyl)-6-((4-(morpholinomethyl)ph
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Mol. Formula:
C23H33N7O3
M.W.:
455.56
Type:
Unknown
AlogP:
1.97
Polar Surface Area:
120.59
HBA:
10
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA4555892 Name:
3-(2-(((1r,4r)-4-aminocyclohexyl)amino)-6-((2-(mor
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Mol. Formula:
C25H36N8O2
M.W.:
480.62
Type:
Unknown
AlogP:
2.47
Polar Surface Area:
126.38
HBA:
10
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA5270693 Name:
phenyl-2-((4-(4-(dimethylamino)piperidin-1-yl)-2-m
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Mol. Formula:
C33H34N6O3
M.W.:
562.67
Type:
---
AlogP:
6.13
Polar Surface Area:
95.61
HBA:
8
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
CLOSE
ALA5209072 Name:
N4-(1H-indazol-6-yl)-6-methyl-N2-[4-(4-methylpiper
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Mol. Formula:
C23H26N8
M.W.:
414.52
Type:
---
AlogP:
3.90
Polar Surface Area:
85.00
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA5206811 Name:
N2-[4-(4,4-difluoro-1-piperidyl)phenyl]-N4-(1H-ind
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Mol. Formula:
C23H23F2N7
M.W.:
435.48
Type:
---
AlogP:
5.38
Polar Surface Area:
81.76
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA5206707 Name:
4-[[4-(1H-indazol-6-ylamino)-5-methyl-pyrimidin-2-
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Mol. Formula:
C25H28N8O2
M.W.:
472.55
Type:
---
AlogP:
3.21
Polar Surface Area:
120.09
HBA:
8
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA5206292 Name:
N4-(1H-indazol-6-yl)-N2-[4-(4-methylpiperazin-1-yl
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Mol. Formula:
C23H23F3N8
M.W.:
468.49
Type:
---
AlogP:
4.61
Polar Surface Area:
85.00
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA5201786 Name:
ethyl 4-(1H-indazol-6-ylamino)-2-[4-(4-methylpiper
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Mol. Formula:
C25H28N8O2
M.W.:
472.55
Type:
---
AlogP:
3.77
Polar Surface Area:
111.30
HBA:
9
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA5201445 Name:
N4-indan-5-yl-5-methyl-N2-[4-(4-methylpiperazin-1-
Show More⌵
Mol. Formula:
C25H30N6
M.W.:
414.56
Type:
---
AlogP:
4.51
Polar Surface Area:
56.32
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA5200825 Name:
5-methyl-N4-(3-methyl-1H-indazol-6-yl)-N2-[4-(4-me
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Mol. Formula:
C24H28N8
M.W.:
428.54
Type:
---
AlogP:
4.21
Polar Surface Area:
85.00
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA5199913 Name:
N4-(1H-indazol-6-yl)-5-methoxy-N2-[4-(4-methylpipe
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Mol. Formula:
C23H26N8O
M.W.:
430.52
Type:
---
AlogP:
3.60
Polar Surface Area:
94.23
HBA:
8
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA5198664 Name:
N4-(1H-indol-5-yl)-5-methyl-N2-[4-(4-methylpiperaz
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Mol. Formula:
C24H27N7
M.W.:
413.53
Type:
---
AlogP:
4.51
Polar Surface Area:
72.11
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA5198489 Name:
N4-(1H-indazol-6-yl)-5-methyl-N2-[4-(4-methylpiper
Show More⌵
Mol. Formula:
C23H26N8
M.W.:
414.52
Type:
---
AlogP:
3.90
Polar Surface Area:
85.00
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA5198330 Name:
5-chloro-N4-(1H-indazol-6-yl)-N2-[4-(4-methylpiper
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Mol. Formula:
C22H23ClN8
M.W.:
434.94
Type:
---
AlogP:
4.25
Polar Surface Area:
85.00
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA5193810 Name:
5-fluoro-N4-(1H-indazol-6-yl)-N2-[4-(4-methylpiper
Show More⌵
Mol. Formula:
C22H23FN8
M.W.:
418.48
Type:
---
AlogP:
3.73
Polar Surface Area:
85.00
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA5193112 Name:
N4-(1H-indazol-5-yl)-5-methyl-N2-[4-(4-methylpiper
Show More⌵
Mol. Formula:
C23H26N8
M.W.:
414.52
Type:
---
AlogP:
3.90
Polar Surface Area:
85.00
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
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