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ALA4482881 Name:
8-Amino-6-(3,4,5-trimethoxyphenyl)-2-phenyl-1,2,4-
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Mol. Formula:
C20H19N5O4
M.W.:
393.40
Type:
Unknown
AlogP:
2.16
Polar Surface Area:
105.90
HBA:
9
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4524485 Name:
N-(4-(8-Amino-3-oxo-2-phenyl-2,3-dihydro-1,2,4-tri
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Mol. Formula:
C25H26N6O2S2
M.W.:
506.66
Type:
Unknown
AlogP:
4.78
Polar Surface Area:
107.31
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4531815 Name:
8-Amino-6-(3,4-dihydroxyphenyl)-2-phenyl-1,2,4-tri
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Mol. Formula:
C17H13N5O3
M.W.:
335.32
Type:
Unknown
AlogP:
1.54
Polar Surface Area:
118.67
HBA:
8
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4560207 Name:
8-Amino-6-(3,5-di-tert-butyl-4-methoxyphenyl)-2-ph
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Mol. Formula:
C26H31N5O2
M.W.:
445.57
Type:
Unknown
AlogP:
4.73
Polar Surface Area:
87.44
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA4548500 Name:
8-(3,4-dichlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrah
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Mol. Formula:
C17H17Cl2N5O2
M.W.:
394.26
Type:
Unknown
AlogP:
1.76
Polar Surface Area:
65.06
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA4547517 Name:
8-Amino-6-(3,4-dimethoxyphenyl)-2-phenyl-1,2,4-tri
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Mol. Formula:
C19H17N5O3
M.W.:
363.38
Type:
Unknown
AlogP:
2.15
Polar Surface Area:
96.67
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA4745482 Name:
4-(furan-2-yl)-6-(1-((6-(methoxymethyl)pyridin-2-y
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Mol. Formula:
C18H17N7O2
M.W.:
363.38
Type:
Unknown
AlogP:
2.17
Polar Surface Area:
117.77
HBA:
9
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4742132 Name:
N-(4-methoxy-7-morpholinobenzo[d]thiazol-2-yl)-5,6
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Mol. Formula:
C18H22N4O3S
M.W.:
374.47
Type:
Unknown
AlogP:
2.94
Polar Surface Area:
66.93
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA4741609 Name:
2-(5-(4-(2-(5-amino-8-(furan-2-yl)-2-oxothiazolo[5
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Mol. Formula:
C24H23F2N9O3S
M.W.:
555.57
Type:
Unknown
AlogP:
1.47
Polar Surface Area:
153.81
HBA:
12
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
Type:
Small molecule
AlogP:
2.84
Polar Surface Area:
139.42
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4776284 Name:
(+/-)-Pentan-3-yl 4-(furan-2-yl)-6-methyl-2-oxo-1,
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Mol. Formula:
C15H20N2O4
M.W.:
292.34
Type:
Unknown
AlogP:
2.64
Polar Surface Area:
80.57
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.82
DETAILS
CLOSE
ALA4776203 Name:
(+/-)-Isobutyl 4-(furan-3-yl)-6-methyl-2-thioxo-1,
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Mol. Formula:
C14H18N2O3S
M.W.:
294.38
Type:
Unknown
AlogP:
2.27
Polar Surface Area:
63.50
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA4776088 Name:
(+/-)-4-(Furan-3-yl)-6-methyl-5-(3-methylbutanoyl)
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Mol. Formula:
C14H18N2O3
M.W.:
262.31
Type:
Unknown
AlogP:
2.52
Polar Surface Area:
71.34
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.88
DETAILS
CLOSE
ALA4765154 Name:
N-(7-methoxy-4-morpholino-1H-benzo[d]imidazol-2-yl
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Mol. Formula:
C23H27N5O4
M.W.:
437.50
Type:
Unknown
AlogP:
2.50
Polar Surface Area:
91.95
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4763600 Name:
4-Methoxy-N-(4-methoxy-7-morpholin-4-yl-benzo[d]th
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Mol. Formula:
C19H26N4O4S
M.W.:
406.51
Type:
Unknown
AlogP:
2.78
Polar Surface Area:
76.16
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA4762582 Name:
4-hydroxy-N-(4-methoxy-7-morpholinothiazolo[4,5-c]
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Mol. Formula:
C18H25N5O4S
M.W.:
407.50
Type:
Unknown
AlogP:
1.92
Polar Surface Area:
100.05
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA4760867 Name:
(+)-5-amino-3-(2-(4-(2,4-difluoro-5-(2-(methylsulf
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Mol. Formula:
C25H26F2N8O4S2
M.W.:
604.67
Type:
Unknown
AlogP:
2.20
Polar Surface Area:
143.01
HBA:
13
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA4760845 Name:
4-Hydroxy-4-methyl-N-(4-(2-fluoroethoxy)-7-morphol
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Mol. Formula:
C20H27FN4O4S
M.W.:
438.53
Type:
Unknown
AlogP:
2.86
Polar Surface Area:
87.16
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA4759461 Name:
4-amino-6-(2-fluoroethoxy)-2-(furan-2-yl)-N-((3-me
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Mol. Formula:
C18H18FN5O3
M.W.:
371.37
Type:
Unknown
AlogP:
2.30
Polar Surface Area:
116.16
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4578482 Name:
2-(4-(8-Amino-3-oxo-2-phenyl-2,3-dihydro-1,2,4-tri
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Mol. Formula:
C19H14N6O2
M.W.:
358.36
Type:
Unknown
AlogP:
2.03
Polar Surface Area:
111.23
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
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