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ALA4513643 Name:
2-{[6-(4-Bromophenyl)-2-ethylimidazo[2,1-b][1,3,4]
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Mol. Formula:
C24H21BrN6O2S2
M.W.:
569.51
Type:
Unknown
AlogP:
5.74
Polar Surface Area:
95.45
HBA:
9
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA4483654 Name:
N-[2-(4-Nitrophenyl)-1H-indol-3-ylmethylene]-N'-(4
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Mol. Formula:
C24H17N5O2S
M.W.:
439.50
Type:
Unknown
AlogP:
6.31
Polar Surface Area:
96.21
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA4538839 Name:
2-Allylsulfanyl-6-phenylimidazo[2,1-b][1,3,4]thiad
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Mol. Formula:
C13H11N3S2
M.W.:
273.39
Type:
Unknown
AlogP:
3.74
Polar Surface Area:
30.19
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4525222 Name:
5-Ethyl-3-(4-hydroxyphenyl)-2-{[2-(4-nitrophenyl)-
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Mol. Formula:
C26H21N5O4S
M.W.:
499.55
Type:
Unknown
AlogP:
5.70
Polar Surface Area:
124.19
HBA:
7
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA4524672 Name:
Acetic acid 2-{2-[(2-allylsulfanyl-6-phenylimidazo
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Mol. Formula:
C21H20N6O3S3
M.W.:
500.63
Type:
Unknown
AlogP:
3.61
Polar Surface Area:
110.31
HBA:
11
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA4521107 Name:
2-{[6-(4-Bromophenyl)-2-ethylimidazo[2,1-b][1,3,4]
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Mol. Formula:
C20H19BrN6O2S2
M.W.:
519.45
Type:
Unknown
AlogP:
4.59
Polar Surface Area:
97.00
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA4534866 Name:
N1-(2-Ethyl-6-(4-bromophenyl)imidazo[2,1-b]-1,3,4-
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Mol. Formula:
C20H17BrN6OS2
M.W.:
501.44
Type:
Unknown
AlogP:
4.81
Polar Surface Area:
86.84
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA4534537 Name:
2-Ethyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole-5
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Cas Number:
80774-15-8
Mol. Formula:
C13H11N3OS
M.W.:
257.32
Type:
Unknown
AlogP:
2.83
Polar Surface Area:
47.26
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4534243 Name:
(Z)-2-((E)-((6-(4-bromophenyl)-2-ethylimidazo[2,1-
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Mol. Formula:
C23H19BrN6O2S2
M.W.:
555.48
Type:
Unknown
AlogP:
5.35
Polar Surface Area:
95.45
HBA:
9
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4531498 Name:
{2-[(2-Allylsulfanyl-6-phenylimidazo[2,1-b][1,3,4]
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Mol. Formula:
C19H16N6O3S3
M.W.:
472.58
Type:
Unknown
AlogP:
3.13
Polar Surface Area:
121.31
HBA:
10
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA4560449 Name:
Acetic acid 2-[2-[(2-ethyl-6-phenylimidazo[2,1-b][
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Mol. Formula:
C26H24N6O4S2
M.W.:
548.65
Type:
Unknown
AlogP:
4.52
Polar Surface Area:
121.75
HBA:
11
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA4558836 Name:
N-[2-Ethyl-6-(4-nitrophenyl)imidazo[2,1-b][1,3,4]t
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Mol. Formula:
C22H16N8O4S2
M.W.:
520.56
Type:
Unknown
AlogP:
4.83
Polar Surface Area:
156.98
HBA:
11
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA4556387 Name:
N1-(2-Ethyl-6-phenylimidazo[2,1-b]-1,3,4-thiadiazo
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Mol. Formula:
C14H14N6S2
M.W.:
330.44
Type:
Unknown
AlogP:
2.19
Polar Surface Area:
80.60
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4555640 Name:
Acetic acid 2-(2-{[2-(4-chlorophenyl)-1H-indol-3-y
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Mol. Formula:
C22H19ClN4O3S
M.W.:
454.94
Type:
Unknown
AlogP:
4.36
Polar Surface Area:
95.91
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4553912 Name:
2-{[2-(4-Chlorophenyl)-1H-indol-3-ylmethylene]hydr
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Mol. Formula:
C20H17ClN4O2S
M.W.:
412.90
Type:
Unknown
AlogP:
3.79
Polar Surface Area:
89.84
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4570275 Name:
Acetic acid 2-(2-{[2-ethyl-6-(4-nitrophenyl)imidaz
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Mol. Formula:
C20H19N7O5S2
M.W.:
501.55
Type:
Unknown
AlogP:
2.80
Polar Surface Area:
153.45
HBA:
12
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4569425 Name:
2-[(2-Allylsulfanyl-6-phenylimidazo[2,1-b][1,3,4]t
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Mol. Formula:
C25H22N6O2S3
M.W.:
534.69
Type:
Unknown
AlogP:
5.69
Polar Surface Area:
95.45
HBA:
10
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.14
DETAILS
CLOSE
ALA4566659 Name:
5-Ethyl-2-{[2-(4-nitrophenyl)-1H-indol-3-yl-methyl
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Mol. Formula:
C20H17N5O3S
M.W.:
407.46
Type:
Unknown
AlogP:
4.07
Polar Surface Area:
112.75
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4529689 Name:
2-{[2-(4-Chlorophenyl)-1H-indol-3-ylmethylene]hydr
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Mol. Formula:
C26H21ClN4O2S
M.W.:
489.00
Type:
Unknown
AlogP:
6.44
Polar Surface Area:
81.05
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA4529644 Name:
2-[(2-Ethyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazo
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Mol. Formula:
C16H14N6OS2
M.W.:
370.46
Type:
Unknown
AlogP:
2.57
Polar Surface Area:
84.01
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
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