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ALA4476073 Name:
1-Cyclopentyl-1-(1-((1-(4-(pyridin-4-ylsulfonyl)ph
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Mol. Formula:
C34H42N4O2S
M.W.:
570.80
Type:
Unknown
AlogP:
5.29
Polar Surface Area:
65.54
HBA:
6
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4474336 Name:
rac-4-(3-((4-((S)-cyano((1S,2R)-2-methoxycyclopent
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Mol. Formula:
C30H36N4O
M.W.:
468.65
Type:
Unknown
AlogP:
4.98
Polar Surface Area:
63.29
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4537683 Name:
4-(4-(1-Cyclopentyl-1,2,3,4-tetrahydroisoquinolin-
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Mol. Formula:
C31H40N4
M.W.:
468.69
Type:
Unknown
AlogP:
5.47
Polar Surface Area:
42.30
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4522767 Name:
2-Cyclobutyl-4-cyclopentyl-4-(1-((1-(4-(pyridin-4-
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Mol. Formula:
C38H48N4O2S
M.W.:
624.90
Type:
Unknown
AlogP:
6.56
Polar Surface Area:
56.75
HBA:
6
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA4533602 Name:
rac-4-(3-((4-(Cyano(cyclopentyl)(phenyl)methyl)pip
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Mol. Formula:
C29H34N4
M.W.:
438.62
Type:
Unknown
AlogP:
5.36
Polar Surface Area:
54.06
HBA:
4
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4532417 Name:
4-Cyclopentyl-2-(oxetan-3-ylmethyl)-4-(1-((1-(4-(p
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Mol. Formula:
C38H48N4O3S
M.W.:
640.89
Type:
Unknown
AlogP:
5.65
Polar Surface Area:
65.98
HBA:
7
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA4553102 Name:
Methyl ((1S,2R)-2-((S)-1-(1-((1-(4-((1-Acryloylaze
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Mol. Formula:
C39H52FN5O5S
M.W.:
721.94
Type:
Unknown
AlogP:
4.31
Polar Surface Area:
102.50
HBA:
8
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4551865 Name:
4-Cyclopentyl-2-isopropyl-4-(1-((1-(4-(pyridin-4-y
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Mol. Formula:
C37H48N4O2S
M.W.:
612.88
Type:
Unknown
AlogP:
6.41
Polar Surface Area:
56.75
HBA:
6
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA4571451 Name:
Methyl ((1S,2R)-2-((S)-1-(1-((1-(4-((1-((E)-4-(Dim
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Mol. Formula:
C44H63FN6O5S
M.W.:
807.09
Type:
Unknown
AlogP:
5.02
Polar Surface Area:
105.74
HBA:
9
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
14
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4570651 Name:
4-(2-(4-(1-Cyclopentyl-1,2,3,4-tetrahydroisoquinol
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Mol. Formula:
C28H35N3O
M.W.:
429.61
Type:
Unknown
AlogP:
4.88
Polar Surface Area:
48.29
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4568235 Name:
rac-Methyl ((1S,2R)-2-((S)-Cyano(1-((1-(4-cyanophe
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Mol. Formula:
C31H37N5O2
M.W.:
511.67
Type:
Unknown
AlogP:
4.69
Polar Surface Area:
92.39
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4530300 Name:
Methyl ((1S,2R)-2-((S)-2-(Azetidin-1-yl)-1-(1-((1-
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Mol. Formula:
C43H57F3N6O5S
M.W.:
827.03
Type:
Unknown
AlogP:
4.63
Polar Surface Area:
105.74
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
14
Passes Ro3:
N
QED Weighted:
0.27
DETAILS
CLOSE
ALA4528850 Name:
4-(3-((4-(1-Cyclopentyl-1,2,3,4-tetrahydroisoquino
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Mol. Formula:
C32H42N4
M.W.:
482.72
Type:
Unknown
AlogP:
5.72
Polar Surface Area:
42.30
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4528467 Name:
Methyl ((1S,2R)-2-((S)-1-(1-((1-(4-((1-((E)-4-(Dim
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Mol. Formula:
C43H61FN6O5S
M.W.:
793.06
Type:
Unknown
AlogP:
4.63
Polar Surface Area:
105.74
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
14
Passes Ro3:
N
QED Weighted:
0.27
DETAILS
CLOSE
ALA4527504 Name:
Methyl ((1S,2R)-2-((S)-2-(Azetidin-1-yl)-1-(3-fluo
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Mol. Formula:
C45H62F2N6O5S
M.W.:
837.09
Type:
Unknown
AlogP:
5.12
Polar Surface Area:
105.74
HBA:
9
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
14
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4516680 Name:
4-Cyclopentyl-2-methyl-4-(1-((1-(4-(pyridin-4-ylsu
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Mol. Formula:
C35H44N4O2S
M.W.:
584.83
Type:
Unknown
AlogP:
5.64
Polar Surface Area:
56.75
HBA:
6
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4515980 Name:
rac-4-(3-((4-((S)-Cyano((1R,2S)-2-methoxycyclopent
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Mol. Formula:
C30H36N4O
M.W.:
468.65
Type:
Unknown
AlogP:
4.98
Polar Surface Area:
63.29
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4576593 Name:
4-(4-(4-(1-Cyclopentyl-1,2,3,4-tetrahydroisoquinol
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Mol. Formula:
C30H39N3O
M.W.:
457.66
Type:
Unknown
AlogP:
5.66
Polar Surface Area:
48.29
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA4581439 Name:
1-(1-((1-(4-(Cyclobutylsulfonyl)phenyl)azetidin-3-
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Mol. Formula:
C33H45N3O2S
M.W.:
547.81
Type:
Unknown
AlogP:
5.39
Polar Surface Area:
52.65
HBA:
5
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4578509 Name:
1-(1-((1-(4-(Cyclohexylsulfonyl)phenyl)azetidin-3-
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Mol. Formula:
C35H49N3O2S
M.W.:
575.86
Type:
Unknown
AlogP:
6.17
Polar Surface Area:
52.65
HBA:
5
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
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