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ALA4877869 Name:
N-(2-(4-((4-tert-butylpiperazin-1-yl)methyl)phenyl
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Mol. Formula:
C31H42N6O6S
M.W.:
626.78
Type:
Unknown
AlogP:
3.71
Polar Surface Area:
100.13
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4790186 Name:
(S)-4-Amino-6-(1-(1-(3,5-difluorophenyl)-6-fluoro-
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Mol. Formula:
C20H14F3N7
M.W.:
409.38
Type:
Unknown
AlogP:
3.86
Polar Surface Area:
105.44
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4790068 Name:
(E)-N-(4-(4-cyano-5-morpholino-2-(1H-1,2,4-triazol
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Mol. Formula:
C26H24N8O3S
M.W.:
528.60
Type:
Unknown
AlogP:
4.07
Polar Surface Area:
140.55
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA4789901 Name:
(2S)-N1-(6-{2-[(1S)-1-Cyclopropylethyl]-7-methyl-1
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Mol. Formula:
C26H29N7O3
M.W.:
487.56
Type:
Unknown
AlogP:
2.94
Polar Surface Area:
125.93
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4789701 Name:
1-(4-(4-cyano-5-morpholino-2-(1H-1,2,4-triazol-3-y
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Mol. Formula:
C24H20FN7O2S
M.W.:
489.54
Type:
Unknown
AlogP:
4.69
Polar Surface Area:
118.96
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4789623 Name:
1-(4-(4-cyano-5-morpholino-2-(1H-1,2,4-triazol-3-y
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Mol. Formula:
C24H20FN7O2S
M.W.:
489.54
Type:
Unknown
AlogP:
4.69
Polar Surface Area:
118.96
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4789524 Name:
4-(4-(2-Aminopyrimidin-5-yl)-6-morpholino-1,3,5-tr
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Mol. Formula:
C20H22N8O3
M.W.:
422.45
Type:
Unknown
AlogP:
1.24
Polar Surface Area:
132.48
HBA:
10
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4782224 Name:
5-[2-Amino-3-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2
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Mol. Formula:
C24H25N7O
M.W.:
427.51
Type:
Unknown
AlogP:
3.44
Polar Surface Area:
94.34
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4782133 Name:
4-((4-(2-Aminothiazol-5-yl)-6-morpholino-1,3,5-tri
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Mol. Formula:
C19H21N7O3S
M.W.:
427.49
Type:
Unknown
AlogP:
1.91
Polar Surface Area:
119.59
HBA:
10
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4781956 Name:
(E)-N-(4-(4-cyano-5-morpholino-2-(1H-1,2,4-triazol
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Mol. Formula:
C25H21FN8O2S
M.W.:
516.56
Type:
Unknown
AlogP:
4.20
Polar Surface Area:
131.32
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4548696 Name:
2,4-difluoro-N-(2-methoxy-5-(4-methyl-8-(2-(pyrrol
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Mol. Formula:
C27H27F2N5O4S
M.W.:
555.61
Type:
Unknown
AlogP:
4.56
Polar Surface Area:
106.54
HBA:
8
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4548051 Name:
(S)-5-(4-Morpholino-5a,6,8,9-tetrahydro-5H-pyrimid
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Mol. Formula:
C19H21F3N6O2
M.W.:
422.41
Type:
Unknown
AlogP:
1.74
Polar Surface Area:
89.63
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA4547768 Name:
2,4-difluoro-N-(2-methoxy-5-(4-methyl-8-(2-morphol
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Mol. Formula:
C27H27F2N5O5S
M.W.:
571.61
Type:
Unknown
AlogP:
3.80
Polar Surface Area:
115.77
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4546631 Name:
4-(8-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-9-methyl-9
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Mol. Formula:
C20H28N8O
M.W.:
396.50
Type:
Unknown
AlogP:
2.22
Polar Surface Area:
93.76
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA4546240 Name:
N-Hydroxy-8-(4,6-dimorpholino-1H-pyrazolo[3,4-d]py
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Mol. Formula:
C21H33N7O4
M.W.:
447.54
Type:
Unknown
AlogP:
1.35
Polar Surface Area:
117.87
HBA:
10
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4550818 Name:
1-(4-((8-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-9-meth
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Mol. Formula:
C20H28N8O
M.W.:
396.50
Type:
Unknown
AlogP:
2.37
Polar Surface Area:
93.76
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4756719 Name:
4-(4-(6-Amino-2-methylpyridin-3-yl)-6-morpholino-1
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Mol. Formula:
C22H25N7O3
M.W.:
435.49
Type:
Unknown
AlogP:
2.15
Polar Surface Area:
119.59
HBA:
9
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4756545 Name:
(S)-4-Amino-6-((1-(6-fluoro-3-phenylimidazo[1,2-a]
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Mol. Formula:
C20H16FN7
M.W.:
373.40
Type:
Unknown
AlogP:
3.56
Polar Surface Area:
104.92
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4756034 Name:
(S)-4-Amino-6-((1-(6-fluoro-3-(3-(methylsulfonyl)p
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Mol. Formula:
C21H18FN7O2S
M.W.:
451.49
Type:
Unknown
AlogP:
2.96
Polar Surface Area:
139.06
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4764922 Name:
N,N'-Dimethyl-4-((4-morpholino-6-(1H-pyrrolo[2,3-c
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Mol. Formula:
C23H23N7O3
M.W.:
445.48
Type:
Unknown
AlogP:
2.75
Polar Surface Area:
109.36
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
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