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ALA4475375 Name:
1-(4-(4-Amino-7-(2-(dimethylamino)ethyl)-7H-pyrrol
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Mol. Formula:
C24H30N8O2
M.W.:
462.56
Type:
Unknown
AlogP:
4.17
Polar Surface Area:
127.13
HBA:
8
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4533761 Name:
1-(4-(4-Amino-7-hexyl-7H-pyrrolo[2,3-d]pyrimidin-5
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Mol. Formula:
C26H33N7O2
M.W.:
475.60
Type:
Unknown
AlogP:
6.19
Polar Surface Area:
123.89
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4557634 Name:
1-(4-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-
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Mol. Formula:
C21H23N7O2
M.W.:
405.46
Type:
Unknown
AlogP:
4.15
Polar Surface Area:
123.89
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4551816 Name:
1-(4-(4-Amino-7-benzyl-7H-pyrrolo[2,3-d]pyrimidin-
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Mol. Formula:
C27H27N7O2
M.W.:
481.56
Type:
Unknown
AlogP:
5.66
Polar Surface Area:
123.89
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA4529106 Name:
1-(4-(4-Amino-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrim
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Mol. Formula:
C25H29N7O2
M.W.:
459.55
Type:
Unknown
AlogP:
5.73
Polar Surface Area:
123.89
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4526888 Name:
tert-Butyl-4-amino-5-(4-(3-(5-(tert-butyl)isoxazol
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Mol. Formula:
C25H29N7O4
M.W.:
491.55
Type:
Unknown
AlogP:
5.39
Polar Surface Area:
150.19
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA4517711 Name:
1-(4-(4-Amino-7H-pyrrolo[2,3-d]pyrimidin-5-yl)phen
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Mol. Formula:
C20H21N7O2
M.W.:
391.44
Type:
Unknown
AlogP:
4.14
Polar Surface Area:
134.75
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4515336 Name:
1-(4-(4-Amino-7-(2-morpholinoethyl)-7H-pyrrolo[2,3
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Mol. Formula:
C26H32N8O3
M.W.:
504.60
Type:
Unknown
AlogP:
3.94
Polar Surface Area:
136.36
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4745588 Name:
2-(2-chloro-6-fluorophenyl)-6-(4-ethyl-3-(hydroxym
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Mol. Formula:
C23H19ClF2N4O3
M.W.:
472.88
Type:
Unknown
AlogP:
3.82
Polar Surface Area:
82.05
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4572972 Name:
1-(4-(4-Amino-7-ethyl-7H-pyrrolo[2,3-d]pyrimidin-5
Show More⌵
Mol. Formula:
C22H25N7O2
M.W.:
419.49
Type:
Unknown
AlogP:
4.63
Polar Surface Area:
123.89
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4572804 Name:
1-(4-(4-Amino-7-(3-morpholinopropyl)-7H-pyrrolo[2,
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Mol. Formula:
C27H34N8O3
M.W.:
518.62
Type:
Unknown
AlogP:
4.33
Polar Surface Area:
136.36
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4581547 Name:
N-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[d]py
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Mol. Formula:
C14H15N3O
M.W.:
241.29
Type:
Unknown
AlogP:
2.72
Polar Surface Area:
47.04
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.90
DETAILS
CLOSE
ALA4753279 Name:
6-(4-ethyl-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-
Show More⌵
Mol. Formula:
C24H22F2N4O3
M.W.:
452.46
Type:
Unknown
AlogP:
3.47
Polar Surface Area:
82.05
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4752247 Name:
2-(2-chloro-6-fluoro-3-methoxyphenyl)-6-(4-ethyl-3
Show More⌵
Mol. Formula:
C24H21ClF2N4O4
M.W.:
502.91
Type:
Unknown
AlogP:
3.82
Polar Surface Area:
91.28
HBA:
8
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4751541 Name:
6-(4-ethyl-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-
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Mol. Formula:
C23H20F2N4O3
M.W.:
438.43
Type:
Unknown
AlogP:
3.16
Polar Surface Area:
82.05
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA4751399 Name:
6-(4-ethyl-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-
Show More⌵
Mol. Formula:
C24H25FN4O3
M.W.:
436.49
Type:
Unknown
AlogP:
3.42
Polar Surface Area:
82.05
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA4791523 Name:
2'-allyloxy-4,4'-dimethoxychalcone
Mol. Formula:
C20H20O4
M.W.:
324.38
Type:
Unknown
AlogP:
4.16
Polar Surface Area:
44.76
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4791380 Name:
2-(2-chloro-6-fluorophenyl)-6-(4-ethyl-3-(hydroxym
Show More⌵
Mol. Formula:
C23H21ClF2N4O3
M.W.:
474.90
Type:
Unknown
AlogP:
3.91
Polar Surface Area:
82.05
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4860565 Name:
7-(4-(2-(4-Amino-5-fluoro-2-oxo-1,2-dihydroquinoli
Show More⌵
Mol. Formula:
C40H40FN9O6
M.W.:
761.82
Type:
Unknown
AlogP:
3.91
Polar Surface Area:
206.69
HBA:
10
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.10
DETAILS
CLOSE
ALA4860038 Name:
4-((6-(4-(2-(4-Amino-5-fluoro-2-oxo-1,2-dihydroqui
Show More⌵
Mol. Formula:
C39H38FN9O6
M.W.:
747.79
Type:
Unknown
AlogP:
3.52
Polar Surface Area:
206.69
HBA:
10
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.10
DETAILS
CLOSE
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