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ALA4514229 Name:
1-(4-(1H-Pyrazolo[3,4-d]pyrimidin-4-yloxy)-2-fluor
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Mol. Formula:
C19H18FN7O3
M.W.:
411.40
Type:
Unknown
AlogP:
4.21
Polar Surface Area:
130.85
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4513662 Name:
3-(4-Bromothiophen-2-yl)-N-(4-(4-methylpiperazin-1
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Mol. Formula:
C18H20BrN5S
M.W.:
418.36
Type:
Unknown
AlogP:
4.40
Polar Surface Area:
47.19
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA4483002 Name:
3-(4-(1H-Pyrrolo[2,3-b]pyridin-5-yl)phenyl)-N-(2-(
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Mol. Formula:
C24H23ClN4O3S
M.W.:
482.99
Type:
Unknown
AlogP:
3.91
Polar Surface Area:
103.95
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA4476842 Name:
N'-(6-chloro-2-{(E)-2-[4-(propan-2-yl)phenyl]ethen
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Mol. Formula:
C25H31ClN4
M.W.:
423.00
Type:
Unknown
AlogP:
6.33
Polar Surface Area:
41.05
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4476644 Name:
5-(5-((3-(4-Methylpiperazin-1-yl)phenyl)amino)-1,3
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Mol. Formula:
C18H18N6OS
M.W.:
366.45
Type:
Unknown
AlogP:
3.17
Polar Surface Area:
81.22
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA4476224 Name:
4-((5-(4-Cyanothiophen-2-yl)-1,3,4-oxadiazol-2-yl)
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Mol. Formula:
C20H20N6O2S
M.W.:
408.49
Type:
Unknown
AlogP:
3.24
Polar Surface Area:
107.08
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA4475895 Name:
1-(4-(1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-3-fluor
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Mol. Formula:
C17H12F4N8O2
M.W.:
436.33
Type:
Unknown
AlogP:
3.68
Polar Surface Area:
122.64
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4475689 Name:
N-(4-(4-Methylpiperazin-1-yl)phenyl)-3-(thiophen-2
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Mol. Formula:
C18H21N5S
M.W.:
339.47
Type:
Unknown
AlogP:
3.63
Polar Surface Area:
47.19
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA4475638 Name:
6-chloro-2-{(E)-2-[4-(methylsulfonyl)phenyl]etheny
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Mol. Formula:
C17H13ClN2O3S
M.W.:
360.82
Type:
Unknown
AlogP:
3.15
Polar Surface Area:
79.89
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA4475159 Name:
1-(4-(1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-2-methy
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Mol. Formula:
C20H21N7O3
M.W.:
407.43
Type:
Unknown
AlogP:
4.38
Polar Surface Area:
130.85
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4475132 Name:
N'-{6-fluoro-2-[(E)-2-(4-fluorophenyl)ethenyl]quin
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Mol. Formula:
C21H22F2N4
M.W.:
368.43
Type:
Unknown
AlogP:
4.44
Polar Surface Area:
41.05
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4474529 Name:
1-(4-(1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-3-fluor
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Mol. Formula:
C20H21FN8O2
M.W.:
424.44
Type:
Unknown
AlogP:
3.96
Polar Surface Area:
122.64
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4474389 Name:
N'-{6-chloro-2-[(E)-2-(3,4-difluorophenyl)ethenyl]
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Mol. Formula:
C23H25ClF2N4
M.W.:
430.93
Type:
Unknown
AlogP:
5.88
Polar Surface Area:
41.05
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4474253 Name:
N,N-diethyl-N'-{2-[(E)-2-(3,4-difluorophenyl)ethen
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Mol. Formula:
C23H25F3N4
M.W.:
414.48
Type:
Unknown
AlogP:
5.36
Polar Surface Area:
41.05
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4539094 Name:
N,N-diethyl-N'-{2-[(E)-2-(4-(propan-2-yl)phenyl)et
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Mol. Formula:
C26H34N4
M.W.:
402.59
Type:
Unknown
AlogP:
6.07
Polar Surface Area:
41.05
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4537870 Name:
N-(2-((4-(Pyridin-3-yl)phenethyl)amino)ethyl)isoqu
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Mol. Formula:
C24H24N4O2S
M.W.:
432.55
Type:
Unknown
AlogP:
3.41
Polar Surface Area:
83.98
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4537754 Name:
3,6-dichloro-N'-(3,4,5-trimethoxybenzoyl)benzo[b]t
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Mol. Formula:
C19H16Cl2N2O5S
M.W.:
455.32
Type:
Unknown
AlogP:
4.31
Polar Surface Area:
85.89
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA4537528 Name:
N'-{6-chloro-2-[(E)-2-(4-fluorophenyl)ethenyl]quin
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Mol. Formula:
C21H22ClFN4
M.W.:
384.89
Type:
Unknown
AlogP:
4.96
Polar Surface Area:
41.05
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4523043 Name:
N'-{2-[(E)-2-(4-methoxyphenyl)ethenyl]benzo[g]quin
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Mol. Formula:
C26H28N4O
M.W.:
412.54
Type:
Unknown
AlogP:
5.33
Polar Surface Area:
50.28
HBA:
5
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA4523041 Name:
1-(4-(1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)phenyl)-
Show More⌵
Mol. Formula:
C25H24N8O2
M.W.:
468.52
Type:
Unknown
AlogP:
5.27
Polar Surface Area:
122.64
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
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