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ALA4513335 Name:
(S)-N-(2-Methoxy-5-(4-((1-pivaloylpyrrolidin-3-yl)
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Mol. Formula:
C24H30N6O4S
M.W.:
498.61
Type:
Unknown
AlogP:
3.13
Polar Surface Area:
126.41
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4476840 Name:
N-(2-amino-2-oxoethyl)-1-(4-(2-(difluoromethyl)-1H
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Mol. Formula:
C23H27F2N9O3
M.W.:
515.53
Type:
Unknown
AlogP:
0.80
Polar Surface Area:
144.39
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4476698 Name:
3-Ethyl-1-(4-{4-[(3S)-3-methylmorpholin-4-yl]pyrim
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Mol. Formula:
C18H23N5O2
M.W.:
341.42
Type:
Unknown
AlogP:
2.51
Polar Surface Area:
79.38
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.89
DETAILS
CLOSE
ALA4475876 Name:
6-(6-methoxy-5-methylpyridin-3-yl)-4-{1-[(oxan-4-y
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Mol. Formula:
C23H28N6O2
M.W.:
420.52
Type:
Unknown
AlogP:
3.04
Polar Surface Area:
78.19
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4475622 Name:
4-(3,4-dimethoxyphenyl)-6-(quinoline-3-yl)quinazol
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Mol. Formula:
C25H19N3O2
M.W.:
393.45
Type:
Unknown
AlogP:
5.53
Polar Surface Area:
57.13
HBA:
5
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4525494 Name:
2-((1S)-1-((6-Amino-5-cyano-4-pyrimidinyl)amino)et
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Mol. Formula:
C25H24FN9O
M.W.:
485.53
Type:
Unknown
AlogP:
2.80
Polar Surface Area:
154.53
HBA:
9
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA4522844 Name:
3-[4-(2-Methanesulfonylpropan-2-yl)-6-{(1R,6S)-3-o
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Mol. Formula:
C20H24N2O4S
M.W.:
388.49
Type:
Unknown
AlogP:
2.81
Polar Surface Area:
89.38
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.87
DETAILS
CLOSE
ALA4522571 Name:
(S)-1-(4-(2-(difluoromethyl)-1H-benzo[d]imidazol-1
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Mol. Formula:
C21H23F2N7O3
M.W.:
459.46
Type:
Unknown
AlogP:
2.29
Polar Surface Area:
109.50
HBA:
9
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4521888 Name:
1-(4-(3-(6-(6-methoxy-5-(trifluoromethyl)pyridin-3
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Mol. Formula:
C28H24F3N5O3
M.W.:
535.53
Type:
Unknown
AlogP:
4.69
Polar Surface Area:
88.52
HBA:
6
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4521863 Name:
4-phenyl-6-(quinoline-3-yl)quinazoline
Mol. Formula:
C23H15N3
M.W.:
333.39
Type:
Unknown
AlogP:
5.51
Polar Surface Area:
38.67
HBA:
3
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4520553 Name:
3-Ethyl-1-[4-(4-{3-oxabicyclo[4.1.0]heptan-6-yl}py
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Mol. Formula:
C19H22N4O2
M.W.:
338.41
Type:
Unknown
AlogP:
2.96
Polar Surface Area:
76.14
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.90
DETAILS
CLOSE
ALA4532505 Name:
(S)-2-(4-(2-(1-((9H-Purin-6-yl)amino)propyl)-4-oxo
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Mol. Formula:
C30H26N8O3
M.W.:
546.59
Type:
Unknown
AlogP:
4.33
Polar Surface Area:
150.71
HBA:
9
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA4561361 Name:
3-Ethyl-1-{4-[4-(2-methanesulfonylpropan-2-yl)-6-{
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Mol. Formula:
C23H30N4O4S
M.W.:
458.58
Type:
Unknown
AlogP:
3.24
Polar Surface Area:
110.28
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA4560411 Name:
(S)-N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(4-(2-(
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Mol. Formula:
C26H33F2N9O3
M.W.:
557.61
Type:
Unknown
AlogP:
1.83
Polar Surface Area:
144.39
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4559414 Name:
3-(4-Morpholinopyrimidin-2-yl)phenol
Mol. Formula:
C14H15N3O2
M.W.:
257.29
Type:
Unknown
AlogP:
1.69
Polar Surface Area:
58.48
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.89
DETAILS
CLOSE
ALA4555271 Name:
(S)-1-(4-(4-(2-(difluoromethyl)-1H-benzo[d]imidazo
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Mol. Formula:
C25H31F2N9O2
M.W.:
527.58
Type:
Unknown
AlogP:
1.78
Polar Surface Area:
104.54
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4554487 Name:
(S)-tert-Butyl-3-((6-(6-methoxy-5-(methylsulfonami
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Mol. Formula:
C24H30N6O5S
M.W.:
514.61
Type:
Unknown
AlogP:
3.49
Polar Surface Area:
135.64
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4553989 Name:
3-(4-{3-Oxabicyclo[4.1.0]heptan-6-yl}pyrimidin-2-y
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Mol. Formula:
C16H16N2O2
M.W.:
268.32
Type:
Unknown
AlogP:
2.53
Polar Surface Area:
55.24
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.91
DETAILS
CLOSE
ALA4553967 Name:
(S)-N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-1-(4-(2
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Mol. Formula:
C24H29F2N9O4
M.W.:
545.55
Type:
Unknown
AlogP:
0.16
Polar Surface Area:
164.62
HBA:
11
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4552869 Name:
N-(2-Methoxy-5-(4-((1-(tetrahydro-2H-pyran-4-carbo
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Mol. Formula:
C26H32N6O5S
M.W.:
540.65
Type:
Unknown
AlogP:
2.90
Polar Surface Area:
135.64
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
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