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ALA36730 Name:
3-Methyl-4-oxo-3,4-dihydro-benzo[d][1,2,3]triazine
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Mol. Formula:
C9H8N4O2
M.W.:
204.19
Type:
Small molecule
AlogP:
-0.57
Polar Surface Area:
90.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA37881 Name:
4-{[3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5
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Mol. Formula:
C15H13ClN8O4
M.W.:
404.77
Type:
Small molecule
AlogP:
-1.03
Polar Surface Area:
180.36
HBA:
9
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA36935 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-benzo[d][1,2,
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Mol. Formula:
C10H9ClN4O2
M.W.:
252.66
Type:
Small molecule
AlogP:
0.13
Polar Surface Area:
90.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA37240 Name:
4-Oxo-3,4-dihydro-benzo[d][1,2,3]triazine-8-carbox
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Mol. Formula:
C8H6N4O2
M.W.:
190.16
Type:
Small molecule
AlogP:
-0.17
Polar Surface Area:
101.99
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA416597 Name:
3-Ethyl-4-oxo-3,4-dihydro-benzo[d][1,2,3]triazine-
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Mol. Formula:
C10H10N4O2
M.W.:
218.22
Type:
Small molecule
AlogP:
-0.09
Polar Surface Area:
90.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA37046 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
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Mol. Formula:
C14H12ClN7O3
M.W.:
361.75
Type:
Small molecule
AlogP:
-0.12
Polar Surface Area:
137.27
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA37125 Name:
3-Carbamoylmethyl-4-oxo-3,4-dihydro-benzo[d][1,2,3
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Mol. Formula:
C10H9N5O3
M.W.:
247.21
Type:
Small molecule
AlogP:
-1.62
Polar Surface Area:
133.96
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA284712 Name:
4-Oxo-3-phenyl-3,4-dihydro-benzo[d][1,2,3]triazine
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Mol. Formula:
C14H10N4O2
M.W.:
266.26
Type:
Small molecule
AlogP:
0.88
Polar Surface Area:
90.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
ALA37801 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
Show More⌵
Mol. Formula:
C14H12ClN7O3
M.W.:
361.75
Type:
Small molecule
AlogP:
-0.12
Polar Surface Area:
137.27
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA290356 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-benzo[d][1,2,
Show More⌵
Mol. Formula:
C10H9ClN4O2
M.W.:
252.66
Type:
Small molecule
AlogP:
0.13
Polar Surface Area:
90.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA288517 Name:
3-Methyl-4-oxo-3,4-dihydro-benzo[d][1,2,3]triazine
Show More⌵
Mol. Formula:
C9H8N4O2
M.W.:
204.19
Type:
Small molecule
AlogP:
-0.57
Polar Surface Area:
90.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA36976 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
Show More⌵
Mol. Formula:
C14H12ClN7O3
M.W.:
361.75
Type:
Small molecule
AlogP:
-0.12
Polar Surface Area:
137.27
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA284302 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
Show More⌵
Mol. Formula:
C17H14ClN9O3
M.W.:
427.81
Type:
Small molecule
AlogP:
0.52
Polar Surface Area:
166.21
HBA:
11
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA36489 Name:
3-Ethyl-4-oxo-3,4-dihydro-benzo[d][1,2,3]triazine-
Show More⌵
Mol. Formula:
C10H10N4O2
M.W.:
218.22
Type:
Small molecule
AlogP:
-0.09
Polar Surface Area:
90.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA36209 Name:
4-Oxo-3-phenyl-3,4-dihydro-benzo[d][1,2,3]triazine
Show More⌵
Mol. Formula:
C14H10N4O2
M.W.:
266.26
Type:
Small molecule
AlogP:
0.88
Polar Surface Area:
90.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
ALA31897 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
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Cas Number:
113942-32-8
Mol. Formula:
C7H6ClN5O3
M.W.:
243.61
Type:
Small molecule
AlogP:
-0.78
Polar Surface Area:
102.38
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA286416 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
Show More⌵
Mol. Formula:
C13H12ClN7O2
M.W.:
333.74
Type:
Small molecule
AlogP:
0.28
Polar Surface Area:
106.21
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA280616 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
Show More⌵
Cas Number:
113942-48-6
Mol. Formula:
C9H10ClN5O3
M.W.:
271.66
Type:
Small molecule
AlogP:
-0.30
Polar Surface Area:
91.38
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA287430 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
Show More⌵
Mol. Formula:
C9H10Cl2N6O2
M.W.:
305.13
Type:
Small molecule
AlogP:
-0.51
Polar Surface Area:
94.18
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA32012 Name:
3-(2-Chloro-ethyl)-4-oxo-3,4-dihydro-imidazo[5,1-d
Show More⌵
Mol. Formula:
C8H9ClN6O3
M.W.:
272.65
Type:
Small molecule
AlogP:
-1.18
Polar Surface Area:
103.41
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
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