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ALA1950863 Name:
(S)-N-((S)-1-(2-(1H-indol-3-yl)ethyl)piperidin-3-y
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Mol. Formula:
C25H39N5O2
M.W.:
441.62
Type:
Small molecule
AlogP:
2.43
Polar Surface Area:
89.26
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA1950862 Name:
(S)-3,3-Dimethyl-2-((S)-2-(methylamino)propanamido
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Mol. Formula:
C22H37N5O2
M.W.:
403.57
Type:
Small molecule
AlogP:
1.34
Polar Surface Area:
86.36
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA1950861 Name:
(S)-3,3-Dimethyl-2-((S)-2-(methylamino)propanamido
Show More⌵
Mol. Formula:
C22H37N5O2
M.W.:
403.57
Type:
Small molecule
AlogP:
1.34
Polar Surface Area:
86.36
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA1950860 Name:
(S)-3,3-Dimethyl-2-((S)-2-(methylamino)propanamido
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Mol. Formula:
C24H37F3N4O2
M.W.:
470.58
Type:
Small molecule
AlogP:
2.97
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA1950859 Name:
(S)-3,3-Dimethyl-2-((S)-2-(methylamino)propanamido
Show More⌵
Mol. Formula:
C23H37N5O4
M.W.:
447.58
Type:
Small molecule
AlogP:
1.86
Polar Surface Area:
116.61
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA1950858 Name:
(S)-N-((S)-1-(4-Hydroxyphenethyl)piperidin-3-yl)-3
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Mol. Formula:
C23H38N4O3
M.W.:
418.58
Type:
Small molecule
AlogP:
1.65
Polar Surface Area:
93.70
HBA:
5
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA1950857 Name:
(S)-3,3-Dimethyl-2-((S)-2-(methylamino)propanamido
Show More⌵
Mol. Formula:
C24H40N4O2
M.W.:
416.61
Type:
Small molecule
AlogP:
2.26
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA1950856 Name:
(S)-N-((S)-1-(4-Bromophenethyl)piperidin-3-yl)-3,3
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Mol. Formula:
C23H37BrN4O2
M.W.:
481.48
Type:
Small molecule
AlogP:
2.71
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA1950855 Name:
(S)-N-((S)-1-(4-Chlorophenethyl)piperidin-3-yl)-3,
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Mol. Formula:
C23H37ClN4O2
M.W.:
437.03
Type:
Small molecule
AlogP:
2.60
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA1950854 Name:
(S)-N-((S)-1-(4-Methoxyphenethyl)piperidin-3-yl)-3
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Mol. Formula:
C24H40N4O3
M.W.:
432.61
Type:
Small molecule
AlogP:
1.96
Polar Surface Area:
82.70
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA1950853 Name:
(S)-N-((S)-1-(3-Methoxyphenethyl)piperidin-3-yl)-3
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Mol. Formula:
C24H40N4O3
M.W.:
432.61
Type:
Small molecule
AlogP:
1.96
Polar Surface Area:
82.70
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA1950852 Name:
(S)-N-((S)-1-(2-Methoxyphenethyl)piperidin-3-yl)-3
Show More⌵
Mol. Formula:
C24H40N4O3
M.W.:
432.61
Type:
Small molecule
AlogP:
1.96
Polar Surface Area:
82.70
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA1950851 Name:
(S)-N-((S)-1-(4-Fluorophenethyl)piperidin-3-yl)-3,
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Mol. Formula:
C23H37FN4O2
M.W.:
420.57
Type:
Small molecule
AlogP:
2.09
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA1950850 Name:
(S)-N-((S)-1-Cyclohexyl-2-((S)-1-(4-fluorophenethy
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Mol. Formula:
C25H39FN4O2
M.W.:
446.61
Type:
Small molecule
AlogP:
2.62
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA1950849 Name:
(S)-N-((S)-1-Cyclohexyl-2-((S)-1-(3-fluorophenethy
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Mol. Formula:
C25H39FN4O2
M.W.:
446.61
Type:
Small molecule
AlogP:
2.62
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA1950848 Name:
(S)-N-((S)-1-Cyclohexyl-2-((S)-1-(2-fluorophenethy
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Mol. Formula:
C25H39FN4O2
M.W.:
446.61
Type:
Small molecule
AlogP:
2.62
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA1950847 Name:
(S)-N-((S)-1-(benzylsulfonyl)piperidin-3-yl)-3,3-d
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Mol. Formula:
C22H36N4O4S
M.W.:
452.62
Type:
Small molecule
AlogP:
1.24
Polar Surface Area:
107.61
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA1950846 Name:
(S)-3,3-Dimethyl-2-((S)-2-(methylamino)propanamido
Show More⌵
Mol. Formula:
C21H34N4O4S
M.W.:
438.59
Type:
Small molecule
AlogP:
1.09
Polar Surface Area:
107.61
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA1950845 Name:
(S)-N-((S)-1-Cyclohexyl-2-oxo-2-((S)-1-((R)-1,2,3,
Show More⌵
Mol. Formula:
C27H42N4O2
M.W.:
454.66
Type:
Small molecule
AlogP:
3.32
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA1950844 Name:
(S)-N-((S)-1-Cyclohexyl-2-((S)-1-(2,2-diphenylethy
Show More⌵
Mol. Formula:
C31H44N4O2
M.W.:
504.72
Type:
Small molecule
AlogP:
4.07
Polar Surface Area:
73.47
HBA:
4
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
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