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ALA4860976 Name:
8-chloro-2-methyl-9-(pyridin-4-yl)-[1,2,4]triazolo
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Mol. Formula:
C15H10ClN5O
M.W.:
311.73
Type:
Unknown
AlogP:
2.59
Polar Surface Area:
75.94
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4860123 Name:
9-bromo-2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-
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Mol. Formula:
C10H7BrN4O
M.W.:
279.10
Type:
Unknown
AlogP:
1.64
Polar Surface Area:
63.05
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4859588 Name:
8-chloro-2-methyl-9-o-tolyl-[1,2,4]triazolo[1,5-c]
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Mol. Formula:
C17H13ClN4O
M.W.:
324.77
Type:
Unknown
AlogP:
3.51
Polar Surface Area:
63.05
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4857707 Name:
N-(4-(8-chloro-2-methyl-5-oxo-5,6-dihydro-[1,2,4]t
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Mol. Formula:
C25H22ClN5O5S
M.W.:
540.00
Type:
Unknown
AlogP:
4.33
Polar Surface Area:
127.68
HBA:
8
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4876887 Name:
2-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-4(
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Mol. Formula:
C8H10N2S
M.W.:
166.25
Type:
Unknown
AlogP:
1.94
Polar Surface Area:
28.68
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
Y
QED Weighted:
0.60
DETAILS
CLOSE
ALA4876721 Name:
8-chloro-2-methyl-9-(5-methyl-1H-indazol-4-yl)-[1,
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Mol. Formula:
C18H13ClN6O
M.W.:
364.80
Type:
Unknown
AlogP:
3.38
Polar Surface Area:
91.73
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4876694 Name:
2-isopropyl-[1,2,4]triazolo[1,5-c]quinazolin-5(6H)
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Mol. Formula:
C12H12N4O
M.W.:
228.25
Type:
Unknown
AlogP:
1.69
Polar Surface Area:
63.05
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA4875904 Name:
N-(4-(8-chloro-2-methyl-5-oxo-5,6-dihydro-[1,2,4]t
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Mol. Formula:
C17H14ClN5O3S
M.W.:
403.85
Type:
Unknown
AlogP:
2.57
Polar Surface Area:
109.22
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4874818 Name:
8-chloro-9-(3-methoxypyridin-4-yl)-2-methyl-[1,2,4
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Mol. Formula:
C16H12ClN5O2
M.W.:
341.76
Type:
Unknown
AlogP:
2.60
Polar Surface Area:
85.17
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4848599 Name:
5-((8-chloro-9-(3-methylpyridin-4-yl)-5-oxo-5,6-di
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Mol. Formula:
C37H23ClN6O7
M.W.:
699.08
Type:
Unknown
AlogP:
5.81
Polar Surface Area:
192.78
HBA:
10
HBD:
4
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA4846481 Name:
N-(4-(8-chloro-2-methyl-5-oxo-5,6-dihydro-[1,2,4]t
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Mol. Formula:
C17H13ClFN5O3S
M.W.:
421.84
Type:
Unknown
AlogP:
2.71
Polar Surface Area:
109.22
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4846039 Name:
9-(4-amino-2-methylphenyl)-8-chloro-2-methyl-[1,2,
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Mol. Formula:
C17H14ClN5O
M.W.:
339.79
Type:
Unknown
AlogP:
3.09
Polar Surface Area:
89.07
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA4866110 Name:
2-isopropyl-9-methoxy-[1,2,4]triazolo[1,5-c]quinaz
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Mol. Formula:
C13H14N4O2
M.W.:
258.28
Type:
Unknown
AlogP:
1.70
Polar Surface Area:
72.28
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA4865760 Name:
4-amino-8-chloroquinoline-3-carboxylic acid
Cas Number:
955328-22-0
Mol. Formula:
C10H7ClN2O2
M.W.:
222.63
Type:
Unknown
AlogP:
2.17
Polar Surface Area:
76.21
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA4864303 Name:
9-(4-aminophenyl)-8-chloro-2-methyl-[1,2,4]triazol
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Mol. Formula:
C16H12ClN5O
M.W.:
325.76
Type:
Unknown
AlogP:
2.78
Polar Surface Area:
89.07
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4864057 Name:
8-chloro-2-methyl-[1,2,4]triazolo[1,5-c]quinazolin
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Mol. Formula:
C10H7ClN4O
M.W.:
234.65
Type:
Unknown
AlogP:
1.53
Polar Surface Area:
63.05
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
Type:
Unknown
AlogP:
2.23
Polar Surface Area:
39.58
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
Y
QED Weighted:
0.60
DETAILS
CLOSE
ALA4863477 Name:
8-chloro-2-methyl-9-(3-methylpyridin-4-yl)-[1,2,4]
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Mol. Formula:
C16H12ClN5O
M.W.:
325.76
Type:
Unknown
AlogP:
2.90
Polar Surface Area:
75.94
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4863322 Name:
N-(4-(8-chloro-2-methyl-5-oxo-5,6-dihydro-[1,2,4]t
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Mol. Formula:
C20H16ClN7O3S
M.W.:
469.91
Type:
Unknown
AlogP:
3.03
Polar Surface Area:
137.90
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4863017 Name:
N-(4-(8-chloro-2-methyl-5-oxo-5,6-dihydro-[1,2,4]t
Show More⌵
Mol. Formula:
C18H16ClN5O3S
M.W.:
417.88
Type:
Unknown
AlogP:
2.88
Polar Surface Area:
109.22
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
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