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ALA4524961 Name:
6-methoxy-N-(4-(pyridin-4-yl)benzyl)benzo[d]thiazo
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Mol. Formula:
C21H17N3O2S
M.W.:
375.45
Type:
Unknown
AlogP:
4.30
Polar Surface Area:
64.11
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA4556979 Name:
N-(4-phenylthiazol-2-yl)-2-(4-(pyridin-4-yl)phenyl
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Mol. Formula:
C22H17N3OS
M.W.:
371.47
Type:
Unknown
AlogP:
5.05
Polar Surface Area:
54.88
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4465088 Name:
N-(6-methoxybenzo[d]thiazol-2-yl)-N-methyl-2-(4-(p
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Mol. Formula:
C22H19N3O2S
M.W.:
389.48
Type:
Unknown
AlogP:
4.57
Polar Surface Area:
55.32
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA3986815 Name:
2-(5-phenyl-4-(2-(trifluoromethyl)phenyl)-1H-1,2,3
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Mol. Formula:
C28H20F3N5O
M.W.:
499.50
Type:
Small molecule
AlogP:
6.33
Polar Surface Area:
72.70
HBA:
5
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA3984748 Name:
N-(4-(1H-Imidazol-1-yl)benzyl)-9H-carbazole-2-carb
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Mol. Formula:
C23H18N4O
M.W.:
366.42
Type:
Small molecule
AlogP:
4.44
Polar Surface Area:
62.71
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA3983462 Name:
N-(Dibenzo[b,d]furan-3-ylmethyl)-4-(pyrazin-2-yl)b
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Mol. Formula:
C24H17N3O2
M.W.:
379.42
Type:
Small molecule
AlogP:
4.97
Polar Surface Area:
68.02
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA3982830 Name:
2-(5-phenyl-4-(pyridin-4-yl)-1H-1,2,3-triazol-1-yl
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Mol. Formula:
C25H19N7O
M.W.:
433.48
Type:
Small molecule
AlogP:
4.10
Polar Surface Area:
98.48
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA3981277 Name:
2-(5-phenyl-4-(pyridin-4-yl)-1H-1,2,3-triazol-1-yl
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Mol. Formula:
C24H18N6OS
M.W.:
438.52
Type:
Small molecule
AlogP:
4.77
Polar Surface Area:
85.59
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA3980962 Name:
2-(5-phenyl-4-(2-(trifluoromethyl)pyridin-4-yl)-1H
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Mol. Formula:
C27H19F3N6O
M.W.:
500.48
Type:
Small molecule
AlogP:
5.73
Polar Surface Area:
85.59
HBA:
6
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA3980141 Name:
N-((6-Cyanonaphthalen-2-yl)methyl)-9H-carbazole-2-
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Mol. Formula:
C25H17N3O
M.W.:
375.43
Type:
Small molecule
AlogP:
5.28
Polar Surface Area:
68.68
HBA:
2
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3978552 Name:
2-(5-phenyl-4-(pyridin-2-yl)-1H-1,2,3-triazol-1-yl
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Mol. Formula:
C26H20N6O
M.W.:
432.49
Type:
Small molecule
AlogP:
4.71
Polar Surface Area:
85.59
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA3972297 Name:
2-(5-phenyl-4-(pyridin-4-yl)-1H-1,2,3-triazol-1-yl
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Mol. Formula:
C26H26N6O
M.W.:
438.54
Type:
Small molecule
AlogP:
4.64
Polar Surface Area:
75.94
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA3976672 Name:
9,9-Difluoro-N-((3-fluoro-2'-methyl-[2,4'-bipyridi
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Mol. Formula:
C26H18F3N3O
M.W.:
445.44
Type:
Small molecule
AlogP:
5.64
Polar Surface Area:
54.88
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4446166 Name:
N-(6-methoxybenzo[d]thiazol-2-yl)-2-(4-(pyridin-3-
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Mol. Formula:
C21H17N3O2S
M.W.:
375.45
Type:
Unknown
AlogP:
4.55
Polar Surface Area:
64.11
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA4445395 Name:
1-([1,1'-biphenyl]-4-yl)-3-(4-(2-methylpyridin-4-y
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Mol. Formula:
C25H21N3O
M.W.:
379.46
Type:
Unknown
AlogP:
6.37
Polar Surface Area:
54.02
HBA:
2
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA3970733 Name:
N-((9H-Fluoren-2-yl)methyl)-[1,1'-biphenyl]-4-carb
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Mol. Formula:
C27H21NO
M.W.:
375.47
Type:
Small molecule
AlogP:
5.85
Polar Surface Area:
29.10
HBA:
1
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
Type:
Small molecule
AlogP:
4.71
Polar Surface Area:
85.59
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA3970071 Name:
N-((2'-Methyl-[2,4'-bipyridin]-5-yl)methyl)-9H-car
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Mol. Formula:
C25H20N4O
M.W.:
392.46
Type:
Small molecule
AlogP:
5.02
Polar Surface Area:
70.67
HBA:
3
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3969251 Name:
N-(4-(2-Methylpyridin-4-yl)benzyl)-9-oxo-9H-fluore
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Mol. Formula:
C27H20N2O2
M.W.:
404.47
Type:
Small molecule
AlogP:
5.20
Polar Surface Area:
59.06
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3968159 Name:
N-(4-(2-Methylpyridin-4-yl)benzyl)dibenzo[b,d]fura
Show More⌵
Mol. Formula:
C26H20N2O2
M.W.:
392.46
Type:
Small molecule
AlogP:
5.89
Polar Surface Area:
55.13
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
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