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ALA4554796 Name:
6-(2,6-dichlorophenyl)-8-ethyl-2-(2'-methyl-2',3'-
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Mol. Formula:
C27H25Cl2N5O
M.W.:
506.44
Type:
Unknown
AlogP:
6.01
Polar Surface Area:
63.05
HBA:
6
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4551299 Name:
8-cyclopropyl-6-(2,6-dichlorophenyl)-2-(4-(4-methy
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Mol. Formula:
C27H26Cl2N6O
M.W.:
521.45
Type:
Unknown
AlogP:
5.60
Polar Surface Area:
66.29
HBA:
7
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4529353 Name:
6-(2,6-dichlorophenyl)-8-(hydroxymethyl)-2-(2'-met
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Mol. Formula:
C26H23Cl2N5O2
M.W.:
508.41
Type:
Unknown
AlogP:
4.80
Polar Surface Area:
83.28
HBA:
7
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4526423 Name:
6-(2,6-dichlorophenyl)-8-methyl-2-(2'-methyl-2',3'
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Mol. Formula:
C26H23Cl2N5O
M.W.:
492.41
Type:
Unknown
AlogP:
5.62
Polar Surface Area:
63.05
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4780868 Name:
methyl 4-(4-(2-allyl-1-(6-(2-hydroxypropan-2-yl)py
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Mol. Formula:
C28H32N8O4
M.W.:
544.62
Type:
Unknown
AlogP:
3.02
Polar Surface Area:
130.64
HBA:
11
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA4861984 Name:
2-ethyl-1-(6-(1-(fluoromethyl)cyclopropyl)pyridin-
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Mol. Formula:
C25H26FN7O
M.W.:
459.53
Type:
Unknown
AlogP:
3.39
Polar Surface Area:
89.66
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4861383 Name:
(R)-2-Allyl-1-(7-hydroxy-7-methyl-6,7-dihydro-5H-c
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Mol. Formula:
C29H34N8O2
M.W.:
526.65
Type:
Unknown
AlogP:
3.12
Polar Surface Area:
104.34
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4861351 Name:
(R)-2-Allyl-1-(7-ethyl-7-hydroxy-6,7-dihydro-5H-cy
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Mol. Formula:
C28H32N8O2
M.W.:
512.62
Type:
Unknown
AlogP:
2.86
Polar Surface Area:
113.13
HBA:
10
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4861168 Name:
(S)-2-Allyl-1-(3-hydroxy-3-methyl-2,3-dihydrofuro[
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Mol. Formula:
C27H30N8O3
M.W.:
514.59
Type:
Unknown
AlogP:
2.26
Polar Surface Area:
113.57
HBA:
11
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4858594 Name:
1-(4-(tert-butyl)-5-chlorothiazol-2-yl)-2-isopropy
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Mol. Formula:
C24H28ClN7OS
M.W.:
498.06
Type:
Unknown
AlogP:
4.96
Polar Surface Area:
89.66
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4857841 Name:
(R)-2-Allyl-1-(8-hydroxy-8-methyl-5,6,7,8-tetrahyd
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Mol. Formula:
C29H34N8O2
M.W.:
526.65
Type:
Unknown
AlogP:
3.20
Polar Surface Area:
104.34
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4856253 Name:
(R)-2-Allyl-1-(7-ethyl-7-hydroxy-6,7-dihydro-5H-cy
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Mol. Formula:
C32H37N9O2
M.W.:
579.71
Type:
Unknown
AlogP:
3.69
Polar Surface Area:
109.27
HBA:
11
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA4879157 Name:
(S)-2-Allyl-1-(7-hydroxy-7-methyl-6,7-dihydro-5H-c
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Mol. Formula:
C28H32N8O2
M.W.:
512.62
Type:
Unknown
AlogP:
2.81
Polar Surface Area:
104.34
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4878479 Name:
1-(6-(6-(1,1-dimethyl-1,2,3,4-tetrahydroisoquinoli
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Mol. Formula:
C27H28N8O
M.W.:
480.58
Type:
Unknown
AlogP:
3.68
Polar Surface Area:
113.45
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA4878176 Name:
2-cyclopropyl-1-(5-fluoro-6-(2-fluoropropan-2-yl)p
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Mol. Formula:
C25H25F2N7O
M.W.:
477.52
Type:
Unknown
AlogP:
4.05
Polar Surface Area:
89.66
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA4878169 Name:
1-(6-(2-ethyl-3-oxo-6-((1,2,3,4-tetrahydroisoquino
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Mol. Formula:
C25H24N8O
M.W.:
452.52
Type:
Unknown
AlogP:
2.94
Polar Surface Area:
113.45
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4877772 Name:
(R)-2-(1,1-Difluoroallyl)-1-(7-ethyl-7-hydroxy-6,7
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Mol. Formula:
C29H32F2N8O2
M.W.:
562.63
Type:
Unknown
AlogP:
3.75
Polar Surface Area:
104.34
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4877308 Name:
1-(2-cyclopropylthiazol-4-yl)-2-isopropyl-6-((1,2,
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Mol. Formula:
C23H25N7OS
M.W.:
447.57
Type:
Unknown
AlogP:
3.89
Polar Surface Area:
89.66
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4877216 Name:
1-(5-fluoro-6-(2-hydroxypropan-2-yl)pyridin-2-yl)-
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Mol. Formula:
C25H28FN7O2
M.W.:
477.54
Type:
Unknown
AlogP:
3.31
Polar Surface Area:
109.89
HBA:
9
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4876612 Name:
(S)-2-Allyl-1-(7-cyclopropyl-7-hydroxy-6,7-dihydro
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Mol. Formula:
C30H34N8O2
M.W.:
538.66
Type:
Unknown
AlogP:
3.20
Polar Surface Area:
104.34
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
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