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ALA4558528 Name:
10-Benzyl-8-fluoro-2-(4-(4-methylpiperazin-1-yl)ph
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Mol. Formula:
C31H29FN4O2
M.W.:
508.60
Type:
Unknown
AlogP:
6.27
Polar Surface Area:
48.05
HBA:
5
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA4860677 Name:
3-(2-Chlorophenyl)-4-((2-(methylthio)phenyhamino)-
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Mol. Formula:
C17H13ClN2O2S
M.W.:
344.82
Type:
Unknown
AlogP:
3.54
Polar Surface Area:
58.20
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA4860051 Name:
3-((3-(Methylthio)phenyhamino)-4-(2-(trifluorometh
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Mol. Formula:
C18H13F3N2O2S
M.W.:
378.38
Type:
Unknown
AlogP:
3.91
Polar Surface Area:
58.20
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4859423 Name:
3-((4-(Benzyloxy)-3-chlorophenyl)amino)-4-(2-metho
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Mol. Formula:
C24H19ClN2O4
M.W.:
434.88
Type:
Unknown
AlogP:
4.41
Polar Surface Area:
76.66
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4859332 Name:
3-(2-(Methylthio)phenyl)amino)-4-(2-(trifluorometh
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Mol. Formula:
C18H13F3N2O2S
M.W.:
378.38
Type:
Unknown
AlogP:
3.91
Polar Surface Area:
58.20
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4858023 Name:
3-(2-Chlorophenyl)-4-((3-(methylthio)phenyl)amino)
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Mol. Formula:
C17H13ClN2O2S
M.W.:
344.82
Type:
Unknown
AlogP:
3.54
Polar Surface Area:
58.20
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA4857914 Name:
3-((4-(5-(2,3-Dihydrobenzo[b][1,4]dioxin-5-yl)-2-m
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Mol. Formula:
C26H19N3O5
M.W.:
453.45
Type:
Unknown
AlogP:
3.48
Polar Surface Area:
109.68
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4857159 Name:
3-(2-Methoxyphenyl)-4-((3-(methylthio)phenynamino)
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Mol. Formula:
C18H16N2O3S
M.W.:
340.40
Type:
Unknown
AlogP:
2.90
Polar Surface Area:
67.43
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4856751 Name:
3-((4-(5-bromo-2-methoxyphenyl)-2,5-dioxo-2,5-dihy
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Mol. Formula:
C18H12BrN3O3
M.W.:
398.22
Type:
Unknown
AlogP:
2.81
Polar Surface Area:
91.22
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA4879311 Name:
3-((3-(Benzyloxy)phenyl)amino)-4-(2-methoxyphenyl)
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Mol. Formula:
C24H20N2O4
M.W.:
400.43
Type:
Unknown
AlogP:
3.75
Polar Surface Area:
76.66
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4878748 Name:
3-(2-Chlorophenyl)-4-((3-fluorophenyhamino)-1H-pyr
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Mol. Formula:
C16H10ClFN2O2
M.W.:
316.72
Type:
Unknown
AlogP:
2.96
Polar Surface Area:
58.20
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.86
DETAILS
CLOSE
ALA4878325 Name:
3-((4-(4-bromo-2-methoxyphenyl)-2,5-dioxo-2,5-dihy
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Mol. Formula:
C18H12BrN3O3
M.W.:
398.22
Type:
Unknown
AlogP:
2.81
Polar Surface Area:
91.22
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA4878043 Name:
3-(2-Methoxyphenyl)-4-((2-(methylthio)phenyhamino)
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Mol. Formula:
C18H16N2O3S
M.W.:
340.40
Type:
Unknown
AlogP:
2.90
Polar Surface Area:
67.43
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4877889 Name:
3-(2-Methoxyphenyl)-4-(naphthalen-1-ylamino)-1H-py
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Mol. Formula:
C21H16N2O3
M.W.:
344.37
Type:
Unknown
AlogP:
3.33
Polar Surface Area:
67.43
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4877795 Name:
3-(2-Methoxyphenyl)-4-((3-(methylsulfonyl)phenyham
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Mol. Formula:
C18H16N2O5S
M.W.:
372.40
Type:
Unknown
AlogP:
1.58
Polar Surface Area:
101.57
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA4877169 Name:
3-((2,5-Dioxo-4-(2-phenoxyphenyl)-2,5-dihydro-1H-p
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Mol. Formula:
C23H15N3O3
M.W.:
381.39
Type:
Unknown
AlogP:
3.83
Polar Surface Area:
91.22
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA4877101 Name:
3-((4-Naphthalen-1-yl)-2,5-dihydro-1H-pyrrol-3-yl)
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Mol. Formula:
C21H13N3O2
M.W.:
339.35
Type:
Unknown
AlogP:
3.19
Polar Surface Area:
81.99
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA4876254 Name:
3-((4-Benzoylphenyl)amino)-4-(2-methoxyphenyl)-1H-
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Mol. Formula:
C24H18N2O4
M.W.:
398.42
Type:
Unknown
AlogP:
3.41
Polar Surface Area:
84.50
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA4876241 Name:
3-((4-Hydroxyphenylamino)-4-(2-(trifluoromethyl)ph
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Mol. Formula:
C17H11F3N2O3
M.W.:
348.28
Type:
Unknown
AlogP:
2.89
Polar Surface Area:
78.43
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4876004 Name:
3-((3,4-Dimethoxyphenyl)amino-4-((2-methoxyphenyl)
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Mol. Formula:
C19H18N2O5
M.W.:
354.36
Type:
Unknown
AlogP:
2.19
Polar Surface Area:
85.89
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
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