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ALA4087502 Name:
(S)-benzyl 2-((S)-2-(benzyloxycarbonylamino)propan
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Mol. Formula:
C35H47N3O8
M.W.:
637.77
Type:
Small molecule
AlogP:
4.72
Polar Surface Area:
149.13
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
19
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA4581195 Name:
rac-biphenyl-4-yl(4-(tetrahydrofuran-2-carbonyl)pi
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Mol. Formula:
C22H24N2O3
M.W.:
364.45
Type:
Unknown
AlogP:
2.82
Polar Surface Area:
49.85
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA4574471 Name:
(1R,3S)-3-(6-Dimethylamino-hexanoylamino)-cyclopen
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Mol. Formula:
C28H37N5O3
M.W.:
491.64
Type:
Unknown
AlogP:
4.66
Polar Surface Area:
90.71
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4081658 Name:
(S)-benzyl 2-((S)-2-(benzyloxycarbonylamino)propan
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Mol. Formula:
C30H37N3O8
M.W.:
567.64
Type:
Small molecule
AlogP:
2.77
Polar Surface Area:
149.13
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
CLOSE
ALA4081526 Name:
(S)-benzyl 2-(2-(benzyloxycarbonylamino)acetamido)
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Mol. Formula:
C33H43N3O8
M.W.:
609.72
Type:
Small molecule
AlogP:
3.94
Polar Surface Area:
149.13
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
19
Passes Ro3:
N
QED Weighted:
0.12
DETAILS
CLOSE
ALA4066131 Name:
(S)-benzyl 2-((S)-2-(benzyloxycarbonylamino)propan
Show More⌵
Mol. Formula:
C35H47N3O8
M.W.:
637.77
Type:
Small molecule
AlogP:
4.72
Polar Surface Area:
149.13
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
19
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA4458935 Name:
Biphenyl-4-yl(4-(cyclopentanecarbonyl)piperazin-1-
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Mol. Formula:
C23H26N2O2
M.W.:
362.47
Type:
Unknown
AlogP:
3.83
Polar Surface Area:
40.62
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA4455553 Name:
(2'-chloro-4'-methoxybiphenyl-4-yl)(4-(1-hydroxycy
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Mol. Formula:
C22H23ClN2O4
M.W.:
414.89
Type:
Unknown
AlogP:
2.82
Polar Surface Area:
70.08
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA4447234 Name:
Biphenyl-4-yl(4-(1-hydroxycyclopentanecarbonyl)pip
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Mol. Formula:
C23H26N2O3
M.W.:
378.47
Type:
Unknown
AlogP:
2.94
Polar Surface Area:
60.85
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.89
DETAILS
CLOSE
ALA4130300 Name:
(S)-6-((1-(cyclopropanecarbonyl)pyrrolidin-3-yl)me
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Mol. Formula:
C28H29N5O2
M.W.:
467.57
Type:
Small molecule
AlogP:
3.62
Polar Surface Area:
70.80
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4130264 Name:
(R)-5-(4-(1H-indazol-3-yl)phenyl)-6-((1-(cycloprop
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Mol. Formula:
C27H27N5O2
M.W.:
453.55
Type:
Small molecule
AlogP:
3.61
Polar Surface Area:
81.66
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4130221 Name:
3-(((R)-1-(cyclopropanecarbonyl)pyrrolidin-3-yl)me
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Mol. Formula:
C29H31N5O3
M.W.:
497.60
Type:
Small molecule
AlogP:
3.25
Polar Surface Area:
80.03
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4130174 Name:
(R)-1-(3-((5-(4-(benzofuran-5-yl)phenyl)-7-oxo-4,6
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Mol. Formula:
C29H26N4O3
M.W.:
478.55
Type:
Small molecule
AlogP:
4.37
Polar Surface Area:
89.91
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4129812 Name:
(R)-8-acetyl-3-((1-(cyclopropanecarbonyl)pyrrolidi
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Mol. Formula:
C32H36N6O3
M.W.:
552.68
Type:
Small molecule
AlogP:
3.47
Polar Surface Area:
91.11
HBA:
6
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4129575 Name:
(R)-5-(4-(1H-indazol-5-yl)phenyl)-6-((1-(cycloprop
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Mol. Formula:
C27H27N5O2
M.W.:
453.55
Type:
Small molecule
AlogP:
3.61
Polar Surface Area:
81.66
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4129431 Name:
(R)-5-(4-(1H-indazol-4-yl)phenyl)-6-((1-(cycloprop
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Mol. Formula:
C27H27N5O2
M.W.:
453.55
Type:
Small molecule
AlogP:
3.61
Polar Surface Area:
81.66
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4129242 Name:
5-(4-(benzofuran-5-yl)phenyl)-6-(((R)-1-((S)-tetra
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Mol. Formula:
C29H29N3O4
M.W.:
483.57
Type:
Small molecule
AlogP:
4.25
Polar Surface Area:
75.35
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4129240 Name:
(R)-3-((1-(cyclopropanecarbonyl)pyrrolidin-3-yl)me
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Mol. Formula:
C30H33N5O2
M.W.:
495.63
Type:
Small molecule
AlogP:
4.40
Polar Surface Area:
70.80
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4129199 Name:
(R)-6-((1-(cyclopropanecarbonyl)pyrrolidin-3-yl)me
Show More⌵
Mol. Formula:
C29H28N4O2
M.W.:
464.57
Type:
Small molecule
AlogP:
4.28
Polar Surface Area:
65.87
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4129083 Name:
6-((1-(cyclopropanecarbonyl)piperidin-4-yl)methyl)
Show More⌵
Mol. Formula:
C29H31N5O2
M.W.:
481.60
Type:
Small molecule
AlogP:
4.01
Polar Surface Area:
70.80
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
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