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ALA4476814 Name:
(1S,3S)-3-(4-(4-(((4-chlorobenzyloxy)carbonylamino
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Mol. Formula:
C26H27ClN2O6
M.W.:
498.96
Type:
Unknown
AlogP:
5.75
Polar Surface Area:
110.89
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4557434 Name:
(1S,3S)-3-(6-(4-(((3-fluorobenzyloxy)carbonylamino
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Mol. Formula:
C25H26FN3O6
M.W.:
483.50
Type:
Unknown
AlogP:
4.63
Polar Surface Area:
123.78
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA5281669 Name:
sodium 1-(4'-(3-(((1-(2-chlorophenyl)ethoxy)carbon
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Mol. Formula:
C32H24ClN2NaO5
M.W.:
575.00
Type:
---
AlogP:
8.24
Polar Surface Area:
101.66
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA5280108 Name:
1-(4-methoxy-3-(3-methylphenethoxy)benzamido)-3-me
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Mol. Formula:
C24H29NO5
M.W.:
411.50
Type:
---
AlogP:
4.00
Polar Surface Area:
84.86
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA5279659 Name:
2-(3-(3-methylphenethoxy)-4-(methylthio)benzamido)
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Mol. Formula:
C27H27NO4S
M.W.:
461.58
Type:
---
AlogP:
4.69
Polar Surface Area:
75.63
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA5277897 Name:
sodium 1-(4'-(3-(((1-phenylethoxy)carbonyl)amino)f
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Mol. Formula:
C32H25N2NaO5
M.W.:
540.55
Type:
---
AlogP:
7.59
Polar Surface Area:
101.66
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA5285905 Name:
2-(7-(4-(4-(((1-(2-chlorophenyl)ethoxy)carbonyl)am
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Mol. Formula:
C30H27ClN2O5
M.W.:
531.01
Type:
---
AlogP:
7.40
Polar Surface Area:
101.66
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA5285576 Name:
2-ethyl-1-(4-methoxy-3-(3-methylphenethoxy)benzami
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Mol. Formula:
C23H27NO5
M.W.:
397.47
Type:
---
AlogP:
3.61
Polar Surface Area:
84.86
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA5288440 Name:
1-(3-(5-chloro-2-fluorophenethoxy)-4-methoxybenzam
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Mol. Formula:
C24H27ClFNO5
M.W.:
463.93
Type:
---
AlogP:
5.02
Polar Surface Area:
84.86
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4472223 Name:
(1S,3S)-3-(2-methyl-6-(3-methyl-4-((phenylmethylsu
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Mol. Formula:
C25H29N3O6S
M.W.:
499.59
Type:
Unknown
AlogP:
4.00
Polar Surface Area:
131.62
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3986868 Name:
2-(4-{[(3,5-dimethoxy-4-methylbenzoyl)(3-phenylpro
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Mol. Formula:
C34H35NO6
M.W.:
553.66
Type:
Small molecule
AlogP:
7.09
Polar Surface Area:
85.30
HBA:
5
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA3984953 Name:
2-(4-{[(3,5-dimethoxy-4-methylbenzoyl)(3-phenylpro
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Mol. Formula:
C34H35NO6
M.W.:
553.66
Type:
Small molecule
AlogP:
7.09
Polar Surface Area:
85.30
HBA:
5
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA3981813 Name:
(4-{[(3,5-dimethoxy-4-methylbenzoyl)(2-phenylethyl
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Mol. Formula:
C27H29NO6
M.W.:
463.53
Type:
Small molecule
AlogP:
4.36
Polar Surface Area:
85.30
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3979511 Name:
4'-{[(3,4-dimethoxybenzoyl)(3-phenylpropyl)amino]m
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Mol. Formula:
C32H31NO5
M.W.:
509.60
Type:
Small molecule
AlogP:
6.34
Polar Surface Area:
76.07
HBA:
4
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA3973793 Name:
[4-({(3,5-dimethoxy-4-methylbenzoyl)[(2E)-3-phenyl
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Mol. Formula:
C28H29NO5
M.W.:
459.54
Type:
Small molecule
AlogP:
5.00
Polar Surface Area:
76.07
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA3972833 Name:
[4-({(3,5-dimethoxy-4-methylbenzoyl)[3-(4-fluoroph
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Mol. Formula:
C28H30FNO5
M.W.:
479.55
Type:
Small molecule
AlogP:
5.05
Polar Surface Area:
76.07
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA3971582 Name:
2-(4-{[(3,5-dimethoxy-4-methylbenzoyl)(3-phenylpro
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Mol. Formula:
C33H33NO6
M.W.:
539.63
Type:
Small molecule
AlogP:
6.78
Polar Surface Area:
85.30
HBA:
5
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA3976876 Name:
4-chloro-2-(4-{[(3,5-dimethoxy-4-methylbenzoyl)(3-
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Mol. Formula:
C33H32ClNO6
M.W.:
574.07
Type:
Small molecule
AlogP:
7.43
Polar Surface Area:
85.30
HBA:
5
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA4648653 Name:
Fluoro[(2S)-2-methoxy-3-{[(9Z)-octadec-9-enoyl]oxy
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Mol. Formula:
C25H43FO7
M.W.:
474.61
Type:
Unknown
AlogP:
5.85
Polar Surface Area:
110.13
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
22
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA4648374 Name:
Fluoro[(2S)-3-{[(9Z)-hexadec-9-enoyl]oxy}-2-methox
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Mol. Formula:
C23H39FO7
M.W.:
446.56
Type:
Unknown
AlogP:
5.07
Polar Surface Area:
110.13
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
20
Passes Ro3:
N
QED Weighted:
0.12
DETAILS
CLOSE
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