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ALA5274698 Name:
1-(4-((5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)oxy)phenyl)-3-(m-tolyl)Show More⌵
Mol. Formula:
C22H21N5O2
M.W.:
387.44
Type:
---
AlogP:
5.32
Polar Surface Area:
91.93
HBA:
4
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA5289303 Name:
1-(4-((5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)phenyl)-3-(m-tolyShow More⌵
Mol. Formula:
C22H22N6O
M.W.:
386.46
Type:
---
AlogP:
5.27
Polar Surface Area:
94.73
HBA:
4
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4594065 Name:
N6-(2-Chlorophenyl)-2-(2-fluorobenzamido)-4,7-dihydrothieno[2,3-c]pyridine-Show More⌵
Mol. Formula:
C22H18ClFN4O3S
M.W.:
472.93
Type:
Unknown
AlogP:
4.48
Polar Surface Area:
104.53
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA4593793 Name:
2-(2-Iodobenzamido)-6-((2-(trifluoromethyl)phenyl)carbamothioyl)-4,5,6,7-teShow More⌵
Mol. Formula:
C23H18F3IN4O2S2
M.W.:
630.46
Type:
Unknown
AlogP:
5.48
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4592445 Name:
6-(Pyridin-3-ylcarbamothioyl)-2-(1H-pyrrole-2-carboxamido)-4,5,6,7-tetrahydShow More⌵
Mol. Formula:
C19H18N6O2S2
M.W.:
426.53
Type:
Unknown
AlogP:
2.58
Polar Surface Area:
116.14
HBA:
5
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4587399 Name:
6-([1,1'-Biphenyl]-2-ylcarbamothioyl)-2-(2-chlorobenzamido)-4,5,6,7-tetrahyShow More⌵
Mol. Formula:
C28H23ClN4O2S2
M.W.:
547.11
Type:
Unknown
AlogP:
6.17
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4587077 Name:
6-((2-Chlorophenyl)carbamothioyl)-2-(4-(trifluoromethyl)benzamido)-4,5,6,7-Show More⌵
Mol. Formula:
C23H18ClF3N4O2S2
M.W.:
539.00
Type:
Unknown
AlogP:
5.53
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4586101 Name:
6-(2,4-Dichlorobenzyl)-2-(4-(trifluoromethyl)benzamido)-4,5,6,7-tetrahydrotShow More⌵
Mol. Formula:
C23H18Cl2F3N3O2S
M.W.:
528.38
Type:
Unknown
AlogP:
5.98
Polar Surface Area:
75.43
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4583980 Name:
2-(2-Chlorobenzamido)-6-(o-tolylcarbamothioyl)-4,5,6,7-tetrahydrothieno[2,3Show More⌵
Mol. Formula:
C23H21ClN4O2S2
M.W.:
485.03
Type:
Unknown
AlogP:
4.82
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4579784 Name:
6-(2,6-Dichlorobenzyl)-2-(3-nitrobenzamido)-4,5,6,7-tetrahydrothieno[2,3-c]Show More⌵
Mol. Formula:
C22H18Cl2N4O4S
M.W.:
505.38
Type:
Unknown
AlogP:
4.87
Polar Surface Area:
118.57
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4576241 Name:
6-((2-Bromophenyl)carbamothioyl)-2-(2-(trifluoromethyl)benzamido)-4,5,6,7-tShow More⌵
Mol. Formula:
C23H18BrF3N4O2S2
M.W.:
583.46
Type:
Unknown
AlogP:
5.64
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4576149 Name:
6-(Butylcarbamothioyl)-2-hexanamido-4,5,6,7-tetrahydrothieno[2,3-c]pyridineShow More⌵
Mol. Formula:
C19H30N4O2S2
M.W.:
410.61
Type:
Unknown
AlogP:
3.40
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4569048 Name:
6-((3,5-Bis(trifluoromethyl)phenyl)carbamothioyl)-2-(2-fluorobenzamido)-4,5Show More⌵
Mol. Formula:
C24H17F7N4O2S2
M.W.:
590.55
Type:
Unknown
AlogP:
6.03
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA4564776 Name:
6-((2-Chlorophenyl)carbamothioyl)-2-(4-methylbenzamido)-4,5,6,7-tetrahydrotShow More⌵
Mol. Formula:
C23H21ClN4O2S2
M.W.:
485.03
Type:
Unknown
AlogP:
4.82
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4564278 Name:
2-(2-Chlorobenzamido)-6-((4-(trifluoromethyl)phenyl)carbamothioyl)-4,5,6,7-Show More⌵
Mol. Formula:
C23H18ClF3N4O2S2
M.W.:
539.00
Type:
Unknown
AlogP:
5.53
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4560569 Name:
2-(2-Chlorobenzamido)-6-(2,6-dichlorobenzyl)-4,5,6,7-tetrahydrothieno[2,3-cShow More⌵
Mol. Formula:
C22H18Cl3N3O2S
M.W.:
494.83
Type:
Unknown
AlogP:
5.62
Polar Surface Area:
75.43
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4560244 Name:
2-(2-Chlorobenzamido)-6-((2-(trifluoromethyl)phenyl)carbamothioyl)-4,5,6,7-Show More⌵
Mol. Formula:
C23H18ClF3N4O2S2
M.W.:
539.00
Type:
Unknown
AlogP:
5.53
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4553946 Name:
6-((2-Bromophenyl)carbamothioyl)-2-(2-chlorobenzamido)-4,5,6,7-tetrahydrothShow More⌵
Mol. Formula:
C22H18BrClN4O2S2
M.W.:
549.90
Type:
Unknown
AlogP:
5.27
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4551716 Name:
6-(3-Chlorobenzyl)-2-(2-fluorobenzamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyrShow More⌵
Mol. Formula:
C22H19ClFN3O2S
M.W.:
443.93
Type:
Unknown
AlogP:
4.45
Polar Surface Area:
75.43
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4551692 Name:
2-(2-Bromobenzamido)-6-((2-(trifluoromethyl)phenyl)carbamothioyl)-4,5,6,7-tShow More⌵
Mol. Formula:
C23H18BrF3N4O2S2
M.W.:
583.46
Type:
Unknown
AlogP:
5.64
Polar Surface Area:
87.46
HBA:
4
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
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