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ALA5198962 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(1-(piperidin-4-ylmethyl)-1H-pyrazol-4-yShow More⌵
Mol. Formula:
C21H20Cl2FN5O2
M.W.:
464.33
Type:
---
AlogP:
4.14
Polar Surface Area:
91.81
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA5197199 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(2-((4-methylpiperazin-1-yl)methyl)pyrimShow More⌵
Mol. Formula:
C22H21Cl2FN6O2
M.W.:
491.35
Type:
---
AlogP:
3.48
Polar Surface Area:
94.22
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA5204421 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(3-methylisoxazol-5-yl)-1H-pyrrole-2-carShow More⌵
Mol. Formula:
C16H10Cl2FN3O3
M.W.:
382.18
Type:
---
AlogP:
4.24
Polar Surface Area:
87.99
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA5202924 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(6-(piperazin-1-yl)pyridin-3-yl)-1H-pyrrShow More⌵
Mol. Formula:
C21H18Cl2FN5O2
M.W.:
462.31
Type:
---
AlogP:
3.75
Polar Surface Area:
90.12
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5201485 Name:
3-amino-5-((4-chloro-3-methylphenyl)amino)-N-isopropyl-1H-1,2,4-triazole-1-Show More⌵
Mol. Formula:
C13H17ClN6O
M.W.:
308.77
Type:
---
AlogP:
2.53
Polar Surface Area:
97.86
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.81
DETAILS
CLOSE
ALA5209433 Name:
4-(2-chloro-6-fluorobenzoyl)-N-(2-(4-methylpiperazin-1-yl)pyrimidin-5-yl)-1Show More⌵
Mol. Formula:
C21H20ClFN6O2
M.W.:
442.88
Type:
---
AlogP:
2.83
Polar Surface Area:
94.22
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA5208879 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(1-((1-methylpiperidin-4-yl)methyl)-1H-pShow More⌵
Mol. Formula:
C22H22Cl2FN5O2
M.W.:
478.36
Type:
---
AlogP:
4.48
Polar Surface Area:
83.02
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5208123 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(1-(1-methylpiperidin-4-yl)-1H-pyrazol-4Show More⌵
Mol. Formula:
C21H20Cl2FN5O2
M.W.:
464.33
Type:
---
AlogP:
4.41
Polar Surface Area:
83.02
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA5207370 Name:
4-(2-chloro-6-fluorobenzoyl)-N-(2-(dimethylamino)pyrimidin-5-yl)-1H-pyrroleShow More⌵
Mol. Formula:
C18H15ClFN5O2
M.W.:
387.80
Type:
---
AlogP:
3.15
Polar Surface Area:
90.98
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA5194814 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(1-methyl-1H-imidazol-4-yl)-1H-pyrrole-2Show More⌵
Mol. Formula:
C16H11Cl2FN4O2
M.W.:
381.19
Type:
---
AlogP:
3.68
Polar Surface Area:
79.78
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA5193573 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(6-(methyl(1-methylpiperidin-4-yl)amino)Show More⌵
Mol. Formula:
C24H24Cl2FN5O2
M.W.:
504.39
Type:
---
AlogP:
4.87
Polar Surface Area:
81.33
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA5192101 Name:
4-(2-chloro-6-fluorobenzoyl)-N-(2-methylpyrimidin-5-yl)-1H-pyrrole-2-carboxShow More⌵
Mol. Formula:
C17H12ClFN4O2
M.W.:
358.76
Type:
---
AlogP:
3.39
Polar Surface Area:
87.74
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
ALA5188920 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(6-((4-methylpiperazin-1-yl)methyl)pyridShow More⌵
Mol. Formula:
C23H22Cl2FN5O2
M.W.:
490.37
Type:
---
AlogP:
4.09
Polar Surface Area:
81.33
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5186248 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(6-((1-methylpiperidin-4-yl)methyl)pyridShow More⌵
Mol. Formula:
C24H23Cl2FN4O2
M.W.:
489.38
Type:
---
AlogP:
5.22
Polar Surface Area:
78.09
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA5181376 Name:
4-(2-chloro-6-fluorobenzoyl)-N-(2-morpholinopyrimidin-5-yl)-1H-pyrrole-2-caShow More⌵
Mol. Formula:
C20H17ClFN5O3
M.W.:
429.84
Type:
---
AlogP:
2.92
Polar Surface Area:
100.21
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA5180089 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)-1H-Show More⌵
Mol. Formula:
C20H18Cl2FN5O2
M.W.:
450.30
Type:
---
AlogP:
4.06
Polar Surface Area:
91.81
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5179461 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(2-(4-methylpiperazin-1-yl)pyrimidin-5-yShow More⌵
Mol. Formula:
C21H19Cl2FN6O2
M.W.:
477.33
Type:
---
AlogP:
3.49
Polar Surface Area:
94.22
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA5179069 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(1-methyl-1H-pyrazol-3-yl)-1H-pyrrole-2-Show More⌵
Mol. Formula:
C16H11Cl2FN4O2
M.W.:
381.19
Type:
---
AlogP:
3.68
Polar Surface Area:
79.78
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA5176592 Name:
4-(2-chloro-6-fluorobenzoyl)-N-(2-methoxypyrimidin-5-yl)-1H-pyrrole-2-carboShow More⌵
Mol. Formula:
C17H12ClFN4O3
M.W.:
374.76
Type:
---
AlogP:
3.09
Polar Surface Area:
96.97
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA5175760 Name:
4-(3,6-dichloro-2-fluorobenzoyl)-N-(6-((1-methylpiperidin-4-yl)oxy)pyridin-Show More⌵
Mol. Formula:
C23H21Cl2FN4O3
M.W.:
491.35
Type:
---
AlogP:
4.81
Polar Surface Area:
87.32
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
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