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ALA1089159 Name:
2-phenyl-1,1-di(pyridin-3-yl)-2-(pyrrolidin-1-yl)e
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Mol. Formula:
C22H23N3O
M.W.:
345.45
Type:
Small molecule
AlogP:
3.55
Polar Surface Area:
49.25
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA1090160 Name:
2-phenyl-2-(piperidin-1-yl)-1,1-di(pyridin-3-yl)et
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Mol. Formula:
C23H25N3O
M.W.:
359.47
Type:
Small molecule
AlogP:
3.94
Polar Surface Area:
49.25
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA1090159 Name:
2-phenyl-2-(piperazin-1-yl)-1,1-di(pyridin-3-yl)et
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Mol. Formula:
C22H24N4O
M.W.:
360.46
Type:
Small molecule
AlogP:
2.36
Polar Surface Area:
61.28
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA1091163 Name:
2-(1,4-oxazepan-4-yl)-2-phenyl-1,1-di(pyridin-3-yl
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Mol. Formula:
C23H25N3O2
M.W.:
375.47
Type:
Small molecule
AlogP:
3.18
Polar Surface Area:
58.48
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
ALA1091162 Name:
2-(diethylamino)-2-phenyl-1,1-di(pyridin-3-yl)etha
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Mol. Formula:
C22H25N3O
M.W.:
347.46
Type:
Small molecule
AlogP:
3.80
Polar Surface Area:
49.25
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA1090818 Name:
2-(azetidin-1-yl)-2-phenyl-1,1-di(pyridin-3-yl)eth
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Mol. Formula:
C21H21N3O
M.W.:
331.42
Type:
Small molecule
AlogP:
3.16
Polar Surface Area:
49.25
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA1090817 Name:
2-(dimethylamino)-2-phenyl-1,1-di(pyridin-3-yl)eth
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Mol. Formula:
C20H21N3O
M.W.:
319.41
Type:
Small molecule
AlogP:
3.02
Polar Surface Area:
49.25
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA1090816 Name:
2-amino-2-phenyl-1,1-di(pyridin-3-yl)ethanol
Mol. Formula:
C18H17N3O
M.W.:
291.35
Type:
Small molecule
AlogP:
2.41
Polar Surface Area:
72.03
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA1088805 Name:
2-phenyl-1,1-di(pyridin-3-yl)ethanol
Mol. Formula:
C18H16N2O
M.W.:
276.34
Type:
Small molecule
AlogP:
2.96
Polar Surface Area:
46.01
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA1088804 Name:
2-morpholino-1,1-di(pyridin-3-yl)octan-1-ol
Mol. Formula:
C22H31N3O2
M.W.:
369.51
Type:
Small molecule
AlogP:
3.38
Polar Surface Area:
58.48
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA1088803 Name:
2-morpholino-1,1-di(pyridin-3-yl)hexan-1-ol
Mol. Formula:
C20H27N3O2
M.W.:
341.46
Type:
Small molecule
AlogP:
2.60
Polar Surface Area:
58.48
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA1091880 Name:
2-morpholino-3-phenyl-1,1-di(pyridin-3-yl)propan-1
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Mol. Formula:
C23H25N3O2
M.W.:
375.47
Type:
Small molecule
AlogP:
2.66
Polar Surface Area:
58.48
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA1091879 Name:
3-methyl-2-morpholino-1,1-di(pyridin-3-yl)butan-1-
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Mol. Formula:
C19H25N3O2
M.W.:
327.43
Type:
Small molecule
AlogP:
2.07
Polar Surface Area:
58.48
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.91
DETAILS
CLOSE
ALA1090795 Name:
2-morpholino-1,1-di(pyridin-3-yl)propan-1-ol
Mol. Formula:
C17H21N3O2
M.W.:
299.37
Type:
Small molecule
AlogP:
1.43
Polar Surface Area:
58.48
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.93
DETAILS
CLOSE
ALA1090794 Name:
2-morpholino-2-phenyl-1,1-di(pyridin-3-yl)ethanol
Mol. Formula:
C22H23N3O2
M.W.:
361.45
Type:
Small molecule
AlogP:
2.79
Polar Surface Area:
58.48
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA1090793 Name:
3-methyl-2-morpholino-1,1-diphenylbutan-1-ol
Mol. Formula:
C21H27NO2
M.W.:
325.45
Type:
Small molecule
AlogP:
3.28
Polar Surface Area:
32.70
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.92
DETAILS
CLOSE
ALA1090792 Name:
2-methyl-1-morpholino-1-phenylpropan-2-ol
Mol. Formula:
C14H21NO2
M.W.:
235.33
Type:
Small molecule
AlogP:
1.83
Polar Surface Area:
32.70
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.87
DETAILS
CLOSE
ALA1090791 Name:
2-morpholino-2-phenylethanol
Cas Number:
20245-73-2
Mol. Formula:
C12H17NO2
M.W.:
207.27
Type:
Small molecule
AlogP:
1.05
Polar Surface Area:
32.70
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.80
DETAILS
CLOSE
ALA1091863 Name:
2-morpholino-1,1,2-triphenylethanol
Mol. Formula:
C24H25NO2
M.W.:
359.47
Type:
Small molecule
AlogP:
4.00
Polar Surface Area:
32.70
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
Type:
Small molecule
AlogP:
5.46
Polar Surface Area:
17.07
HBA:
1
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
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