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ALA4745102 Name:
(R)-2-(5-(4-((1-(2-Fluoro-5-(pyrrolidin-1-yl)pheny
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Mol. Formula:
C28H30FN5O
M.W.:
471.58
Type:
Unknown
AlogP:
5.83
Polar Surface Area:
74.17
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4744981 Name:
rac-2-(5-(3-Chloro-8-fluoro-4-((1-(2-fluorophenyl)
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Mol. Formula:
C24H21ClF2N4O
M.W.:
454.91
Type:
Unknown
AlogP:
6.02
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4744215 Name:
5-(4-((2,5-Dimethylphenyl)amino)quinolin-6-yl)pico
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Mol. Formula:
C23H18N4
M.W.:
350.43
Type:
Unknown
AlogP:
5.53
Polar Surface Area:
61.60
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4743885 Name:
(+/-)-2-(5-(3-Chloro-4-((1-(pyridin-2-yl)ethyl)ami
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Mol. Formula:
C23H22ClN5O
M.W.:
419.92
Type:
Unknown
AlogP:
5.14
Polar Surface Area:
83.82
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4743794 Name:
rac-2-(5-(3,5-Dichloro-4-((1-(2-fluorophenyl)ethyl
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Mol. Formula:
C24H21Cl2FN4O
M.W.:
471.36
Type:
Unknown
AlogP:
6.54
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
Type:
Unknown
AlogP:
4.58
Polar Surface Area:
68.76
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA4742834 Name:
(+/-)-2-(5-(3-Chloro-4-((1-(4-fluorophenyl)ethyl)a
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Mol. Formula:
C24H22ClFN4O
M.W.:
436.92
Type:
Unknown
AlogP:
5.88
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4742065 Name:
(+/-)-2-(5-(7-Chloro-8-((1-(2-fluorophenyl)ethyl)a
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Mol. Formula:
C23H21ClFN5O
M.W.:
437.91
Type:
Unknown
AlogP:
5.28
Polar Surface Area:
83.82
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4741635 Name:
(+/-)-2-(5-(6-Chloro-5-((1-(2-fluorophenyl)ethyl)a
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Mol. Formula:
C23H21ClFN5O
M.W.:
437.91
Type:
Unknown
AlogP:
5.28
Polar Surface Area:
83.82
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4776281 Name:
5-(3-Chloro-4-((2,5-dimethylphenyl)amino)quinolin-
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Mol. Formula:
C23H17ClN4
M.W.:
384.87
Type:
Unknown
AlogP:
6.18
Polar Surface Area:
61.60
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4776179 Name:
rac-2-(5-(3,7-Dichloro-4-((1-(2-fluorophenyl)ethyl
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Mol. Formula:
C24H21Cl2FN4O
M.W.:
471.36
Type:
Unknown
AlogP:
6.54
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4764442 Name:
(R)-2-(4-(3-Chloro-4-((1-(2-fluorophenyl)ethyl)ami
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Mol. Formula:
C26H24ClFN2O
M.W.:
434.94
Type:
Unknown
AlogP:
7.09
Polar Surface Area:
45.15
HBA:
3
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4764418 Name:
2-(5-(3-Chloro-4-((2,5-dimethylphenyl)amino)-2-met
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Mol. Formula:
C25H25ClN4O
M.W.:
432.96
Type:
Unknown
AlogP:
6.24
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4763313 Name:
(+/-)-2-(5-(3-Chloro-4-((1-(3-fluorophenyl)ethyl)a
Show More⌵
Mol. Formula:
C24H22ClFN4O
M.W.:
436.92
Type:
Unknown
AlogP:
5.88
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4763268 Name:
(S)-2-(5-(3-Chloro-4-((1-phenylethyl)amino)quinoli
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Mol. Formula:
C24H23ClN4O
M.W.:
418.93
Type:
Unknown
AlogP:
5.75
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4762023 Name:
(+/-)-2-(5-(3-Chloro-4-((1-(2-fluorophenyl)ethyl)a
Show More⌵
Mol. Formula:
C24H22ClFN4O
M.W.:
436.92
Type:
Unknown
AlogP:
5.88
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4759848 Name:
(R)-3-(1-((3-Chloro-6-(2-(2-hydroxypropan-2-yl)pyr
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Mol. Formula:
C25H21ClFN5O
M.W.:
461.93
Type:
Unknown
AlogP:
5.76
Polar Surface Area:
94.72
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4758143 Name:
rac-2-(5-(3,8-Dichloro-4-((1-(2-fluorophenyl)ethyl
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Mol. Formula:
C24H21Cl2FN4O
M.W.:
471.36
Type:
Unknown
AlogP:
6.54
Polar Surface Area:
70.93
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4779860 Name:
1-(2-(difluoromethoxy)benzyl)-2,2-dimethylindolin-
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Mol. Formula:
C18H17F2NO2
M.W.:
317.34
Type:
Unknown
AlogP:
4.27
Polar Surface Area:
29.54
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA4779359 Name:
8-(4-(2-(5-((4-methylpiperazin-1-yl)methyl)-2-(1H-
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Mol. Formula:
C36H35N5O
M.W.:
553.71
Type:
Unknown
AlogP:
6.81
Polar Surface Area:
57.28
HBA:
5
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
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