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ALA4514212 Name:
1,4-bis(4-(1H-imidazol-1-yl)butyl)benzene
Mol. Formula:
C20H26N4
M.W.:
322.46
Type:
Unknown
AlogP:
4.13
Polar Surface Area:
35.64
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4474542 Name:
2-((1H-imidazol-1-yl)methyl)-1-(4-bromobenzyl)-1H-
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Mol. Formula:
C18H15BrN4
M.W.:
367.25
Type:
Unknown
AlogP:
4.09
Polar Surface Area:
35.64
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4539662 Name:
1-(2-(benzylthio)ethyl)-1H-imidazole
Mol. Formula:
C12H14N2S
M.W.:
218.32
Type:
Unknown
AlogP:
2.82
Polar Surface Area:
17.82
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA4538246 Name:
1-(2-(benzyloxy)-2-(3-bromophenyl)ethyl)-1H-imidaz
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Mol. Formula:
C18H17BrN2O
M.W.:
357.25
Type:
Unknown
AlogP:
4.60
Polar Surface Area:
27.05
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4536337 Name:
1-(6-phenylhexyl)-1H-imidazole
Mol. Formula:
C15H20N2
M.W.:
228.34
Type:
Unknown
AlogP:
3.69
Polar Surface Area:
17.82
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA4520773 Name:
1-(4-phenylbutyl)-1H-imidazole
Mol. Formula:
C13H16N2
M.W.:
200.28
Type:
Unknown
AlogP:
2.91
Polar Surface Area:
17.82
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4520367 Name:
1-(4-benzylphenyl)-2-(1H-imidazol-1-yl)ethanone
Mol. Formula:
C18H16N2O
M.W.:
276.34
Type:
Unknown
AlogP:
3.36
Polar Surface Area:
34.89
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA4534531 Name:
N-benzhydryl-2-(1H-imidazol-1-yl)acetamide
Mol. Formula:
C18H17N3O
M.W.:
291.35
Type:
Unknown
AlogP:
2.79
Polar Surface Area:
46.92
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA4559629 Name:
1-[(4-bromophenyl)methyl]-2-(norbornan-2-ylmethyl)
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Mol. Formula:
C22H23BrN2
M.W.:
395.34
Type:
Unknown
AlogP:
5.83
Polar Surface Area:
17.82
HBA:
2
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4552523 Name:
(S)-1-(4-(4-chlorophenyl)-2-(4-fluorobenzyloxy)but
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Mol. Formula:
C20H20ClFN2O
M.W.:
358.84
Type:
Unknown
AlogP:
4.89
Polar Surface Area:
27.05
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4552455 Name:
4-((1-(4-chlorobenzyl)-1H-benzo[d]imidazol-2-yl)me
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Cas Number:
7188-79-6
Mol. Formula:
C19H20ClN3O
M.W.:
341.84
Type:
Unknown
AlogP:
3.57
Polar Surface Area:
30.29
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA4569236 Name:
2-(cyclopentylmethyl)-1-(p-tolylmethyl)benzimidazo
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Mol. Formula:
C21H24N2
M.W.:
304.44
Type:
Unknown
AlogP:
5.13
Polar Surface Area:
17.82
HBA:
2
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4568996 Name:
1-(4'-bromobiphenyl-4-yl)-2-(1H-imidazol-1-yl)etha
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Mol. Formula:
C17H13BrN2O
M.W.:
341.21
Type:
Unknown
AlogP:
4.20
Polar Surface Area:
34.89
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA4516867 Name:
1-(((2R,4S)-2-(4-chlorophenethyl)-4-(tosylmethyl)-
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Mol. Formula:
C23H25ClN2O4S
M.W.:
460.98
Type:
Unknown
AlogP:
4.06
Polar Surface Area:
70.42
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4589369 Name:
3-(4,5-diphenyl-1H-imidazol-2-yl)-6-methoxyquinoli
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Mol. Formula:
C25H19N3O2
M.W.:
393.45
Type:
Unknown
AlogP:
5.26
Polar Surface Area:
70.77
HBA:
3
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4584763 Name:
2-(1H-imidazol-1-yl)-1-(2,3,4-trichlorophenyl)etha
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Cas Number:
98164-59-1
Mol. Formula:
C11H7Cl3N2O
M.W.:
289.55
Type:
Unknown
AlogP:
3.73
Polar Surface Area:
34.89
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4583097 Name:
1-(5,6,7,8-tetrahydronaphthalen-2-yl)-2-(1H-1,2,4-
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Mol. Formula:
C14H15N3O
M.W.:
241.29
Type:
Unknown
AlogP:
2.04
Polar Surface Area:
47.78
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA4463231 Name:
2-tert-Butyl-2,3-dihydro-1H-4,13-dioxa-2-aza-diben
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Cas Number:
526188-60-3
Mol. Formula:
C22H19NO4
M.W.:
361.40
Type:
Unknown
AlogP:
4.16
Polar Surface Area:
59.75
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4459358 Name:
1-(1-adamantyl)-2-imidazol-1-yl-ethanol
Mol. Formula:
C15H22N2O
M.W.:
246.35
Type:
Unknown
AlogP:
2.46
Polar Surface Area:
38.05
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.89
DETAILS
CLOSE
ALA4464730 Name:
1-[(4-chlorophenyl)methyl]-2-(cyclohexylmethyl)ben
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Mol. Formula:
C21H23ClN2
M.W.:
338.88
Type:
Unknown
AlogP:
5.86
Polar Surface Area:
17.82
HBA:
2
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
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