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ALA4483049 Name:
(1R,2S)-2-cyclohexyl-1-(4-(methylsulfonyl)phenyl)-
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Cas Number:
866484-00-6
Mol. Formula:
C20H24N2O3S2
M.W.:
404.56
Type:
Unknown
AlogP:
4.02
Polar Surface Area:
76.13
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.82
DETAILS
CLOSE
ALA4538137 Name:
1-(4-(3-Chloro-2-fluorophenoxy)pyridin-2-yl)-3-met
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Mol. Formula:
C13H11ClFN3O2
M.W.:
295.70
Type:
Unknown
AlogP:
3.42
Polar Surface Area:
63.25
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.91
DETAILS
CLOSE
ALA4522750 Name:
rac-6-[[(1R,1aR,6aR)-1a-Methyl-6,6a-dihydro-1H-cyc
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Mol. Formula:
C18H16N2O3
M.W.:
308.34
Type:
Unknown
AlogP:
2.48
Polar Surface Area:
79.29
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.91
DETAILS
CLOSE
ALA4522622 Name:
1-(5-(2-Ethoxyethyl)-4-((5-methylpyridin-3-yl)oxy)
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Mol. Formula:
C17H22N4O3
M.W.:
330.39
Type:
Unknown
AlogP:
2.91
Polar Surface Area:
85.37
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA4534484 Name:
3-(6-(3,5-diisopropoxybenzamido)pyridin-3-yl)acryl
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Mol. Formula:
C21H24N2O5
M.W.:
384.43
Type:
Unknown
AlogP:
4.01
Polar Surface Area:
97.75
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA4533000 Name:
(S)-1-(4-((5-Methoxypyridin-3-yl)oxy)-5-(tetrahydr
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Mol. Formula:
C18H22N4O4
M.W.:
358.40
Type:
Unknown
AlogP:
2.92
Polar Surface Area:
94.60
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.85
DETAILS
CLOSE
ALA4531223 Name:
(S)-1-(6'-(2-Hydroxypropoxy)-4-((5-methylpyridin-3
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Mol. Formula:
C21H23N5O4
M.W.:
409.45
Type:
Unknown
AlogP:
3.15
Polar Surface Area:
118.49
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4554222 Name:
1-(5-((1S,3S)-3-Hydroxycyclohexyl)-4-((5-methylpyr
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Mol. Formula:
C19H24N4O3
M.W.:
356.43
Type:
Unknown
AlogP:
3.35
Polar Surface Area:
96.37
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA4553907 Name:
(R)-1-(4-((5-Methoxypyridin-3-yl)oxy)-5-(tetrahydr
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Mol. Formula:
C18H22N4O4
M.W.:
358.40
Type:
Unknown
AlogP:
2.92
Polar Surface Area:
94.60
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.85
DETAILS
CLOSE
ALA4551474 Name:
1-(4-(2,6-Difluorophenoxy)-[3,4'-bipyridin]-6-yl)-
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Mol. Formula:
C18H14F2N4O2
M.W.:
356.33
Type:
Unknown
AlogP:
3.97
Polar Surface Area:
76.14
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
ALA4566968 Name:
1-(6'-(2-Hydroxyethoxy)-4-((4-methylpyridin-3-yl)o
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Mol. Formula:
C20H21N5O4
M.W.:
395.42
Type:
Unknown
AlogP:
2.76
Polar Surface Area:
118.49
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA4529989 Name:
1-(5-((cis)-3-(Hydroxymethyl)cyclobutyl)-4-((5-met
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Mol. Formula:
C18H22N4O3
M.W.:
342.40
Type:
Unknown
AlogP:
2.81
Polar Surface Area:
96.37
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA4529355 Name:
1-(5-(4-Hydroxybutyl)-4-((5-methylpyridin-3-yl)oxy
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Mol. Formula:
C17H22N4O3
M.W.:
330.39
Type:
Unknown
AlogP:
2.64
Polar Surface Area:
96.37
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4529100 Name:
1-(5-((trans)-1,3-Dihydroxycyclobutyl)-4-((5-methy
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Mol. Formula:
C17H20N4O4
M.W.:
344.37
Type:
Unknown
AlogP:
1.67
Polar Surface Area:
116.60
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA4528539 Name:
1-(4-(2,6-Difluorophenoxy)-6'-ethoxy-[3,3'-bipyrid
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Mol. Formula:
C20H18F2N4O3
M.W.:
400.39
Type:
Unknown
AlogP:
4.36
Polar Surface Area:
85.37
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4528120 Name:
1-(4-(2,6-Difluorophenoxy)-6'-(2-hydroxyethoxy)-[3
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Mol. Formula:
C20H18F2N4O4
M.W.:
416.38
Type:
Unknown
AlogP:
3.34
Polar Surface Area:
105.60
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4527697 Name:
(S)-1-(4-((5-Methoxypyridin-3-yl)oxy)-5-(1-methylp
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Mol. Formula:
C19H25N5O3
M.W.:
371.44
Type:
Unknown
AlogP:
2.84
Polar Surface Area:
88.61
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA4518905 Name:
1-(4-(2,6-Difluorophenoxy)-6'-methoxy-[3,3'-bipyri
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Mol. Formula:
C19H16F2N4O3
M.W.:
386.36
Type:
Unknown
AlogP:
3.97
Polar Surface Area:
85.37
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA4516141 Name:
1-(5-(3-Hydroxypropyl)-4-((5-methylpyridin-3-yl)ox
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Mol. Formula:
C16H20N4O3
M.W.:
316.36
Type:
Unknown
AlogP:
2.25
Polar Surface Area:
96.37
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA4515481 Name:
(S)-1-(4-((5-Methoxypyridin-3-yl)oxy)-5-(tetrahydr
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Mol. Formula:
C17H20N4O4
M.W.:
344.37
Type:
Unknown
AlogP:
2.53
Polar Surface Area:
94.60
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.87
DETAILS
CLOSE
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