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ALA4514099 Name:
2-(4-Methylpiperazin-1-yl)ethyl 4-(4-((5-chloro-4-
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Mol. Formula:
C31H38ClN9O2S2
M.W.:
668.29
Type:
Unknown
AlogP:
4.00
Polar Surface Area:
108.97
HBA:
10
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA4483692 Name:
4-((4-((2-(Dimethylphosphoryl)phenyl)amino)thieno[
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Mol. Formula:
C27H31N6O3PS
M.W.:
550.63
Type:
Unknown
AlogP:
4.92
Polar Surface Area:
117.27
HBA:
9
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA4476614 Name:
2-(methylsulfonyl)ethyl 4-(4-((5-chloro-4-((2-(met
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Mol. Formula:
C27H30ClN7O4S3
M.W.:
648.24
Type:
Unknown
AlogP:
3.80
Polar Surface Area:
136.63
HBA:
10
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA4476367 Name:
Pyridin-4-ylmethyl 4-(4-((5-chloro-4-((2-(methylca
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Mol. Formula:
C30H29ClN8O2S2
M.W.:
633.20
Type:
Unknown
AlogP:
5.35
Polar Surface Area:
115.38
HBA:
9
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA4476042 Name:
2-methoxyethyl 4-(4-((5-chloro-4-((2-(methylcarbam
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Mol. Formula:
C27H30ClN7O3S2
M.W.:
600.17
Type:
Unknown
AlogP:
4.40
Polar Surface Area:
111.72
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA4475504 Name:
4-((4-((2-(dimethylphosphoryl)phenyl)amino)-7H-pyr
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Mol. Formula:
C22H25N6O3PS
M.W.:
484.52
Type:
Unknown
AlogP:
3.99
Polar Surface Area:
128.87
HBA:
7
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA4475488 Name:
4-((4-((2-(Dimethylphosphoryl)phenyl)amino)-7H-pyr
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Mol. Formula:
C26H29FN7O2P
M.W.:
521.54
Type:
Unknown
AlogP:
4.31
Polar Surface Area:
123.83
HBA:
7
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA4538710 Name:
2-Cyanoethyl 4-(4-((5-chloro-4-((2-(methylcarbamoy
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Mol. Formula:
C27H27ClN8O2S2
M.W.:
595.15
Type:
Unknown
AlogP:
4.67
Polar Surface Area:
126.28
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA4525498 Name:
Pyridin-3-ylmethyl 4-(4-((5-chloro-4-((2-(methylca
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Mol. Formula:
C30H29ClN8O2S2
M.W.:
633.20
Type:
Unknown
AlogP:
5.35
Polar Surface Area:
115.38
HBA:
9
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA4559783 Name:
2-(Piperidin-1-yl)ethyl 4-(4-((5-chloro-4-((2-(met
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Mol. Formula:
C31H37ClN8O2S2
M.W.:
653.28
Type:
Unknown
AlogP:
5.24
Polar Surface Area:
105.73
HBA:
9
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.27
DETAILS
CLOSE
ALA4558022 Name:
Methyl 3-((4-(4-((5-chloro-4-((2-(methylcarbamoyl)
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Mol. Formula:
C28H30ClN7O4S2
M.W.:
628.18
Type:
Unknown
AlogP:
4.32
Polar Surface Area:
128.79
HBA:
10
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA4556839 Name:
allyl 4-(4-((5-chloro-4-((2-(methylcarbamoyl)pheny
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Mol. Formula:
C27H28ClN7O2S2
M.W.:
582.16
Type:
Unknown
AlogP:
4.94
Polar Surface Area:
102.49
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA4567448 Name:
2-((2-((2-Methoxy-4-morpholinophenyl)amino)-7H-pyr
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Mol. Formula:
C25H27N7O3
M.W.:
473.54
Type:
Unknown
AlogP:
3.65
Polar Surface Area:
116.43
HBA:
8
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4529571 Name:
(2-((2-((1-(2-Methoxyethyl)-1H-pyrazol-4-yl)amino)
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Mol. Formula:
C20H24N7O2P
M.W.:
425.43
Type:
Unknown
AlogP:
3.54
Polar Surface Area:
109.75
HBA:
8
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4517847 Name:
(4-((4-((2-(Dimethylphosphoryl)phenyl)amino)-7H-py
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Mol. Formula:
C25H27N6O3P
M.W.:
490.50
Type:
Unknown
AlogP:
4.17
Polar Surface Area:
112.24
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4515607 Name:
N4-(2-dimethylphosphorylphenyl)-N2-[1-(2-methoxyet
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Mol. Formula:
C20H23N6O2PS
M.W.:
442.49
Type:
Unknown
AlogP:
4.27
Polar Surface Area:
93.96
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4514956 Name:
Dimethyl(2-((2-((4-(piperazin-1-yl)phenyl)amino)-7
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Mol. Formula:
C24H28N7OP
M.W.:
461.51
Type:
Unknown
AlogP:
4.10
Polar Surface Area:
97.97
HBA:
7
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4549746 Name:
N-(4-((4-((2-(dimethylphosphoryl)phenyl)amino)-7H-
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Mol. Formula:
C22H23N6O2P
M.W.:
434.44
Type:
Unknown
AlogP:
4.65
Polar Surface Area:
111.80
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4548762 Name:
Dimethyl(2-((2-((4-(4-methylpiperazin-1-yl)phenyl)
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Mol. Formula:
C25H30N7OP
M.W.:
475.54
Type:
Unknown
AlogP:
4.44
Polar Surface Area:
89.18
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4546732 Name:
4-((4-((2-(Dimethylphosphoryl)phenyl)amino)-7H-pyr
Show More⌵
Mol. Formula:
C28H34N7O3P
M.W.:
547.60
Type:
Unknown
AlogP:
4.57
Polar Surface Area:
133.06
HBA:
8
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
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