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ALA4800500 Name:
(2)-N-(2-(Diethylamino)ethyl)-5-((5-(2-hydroxyethyl)-2-oxoindolin-3-ylideneShow More⌵
Mol. Formula:
C24H32N4O3
M.W.:
424.55
Type:
Unknown
AlogP:
2.73
Polar Surface Area:
97.46
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4799798 Name:
(Z)-N-(2-(Diethylamino)ethyl)-5-((5-fluoro-1-methyl-2-oxoindolin-3-ylidene)Show More⌵
Mol. Formula:
C23H29FN4O2
M.W.:
412.51
Type:
Unknown
AlogP:
3.36
Polar Surface Area:
68.44
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA4799631 Name:
(Z)-2-(3-((4-((2-(Diethylamino)ethyl)carbamoyl)-3,5-dimethyl-1H-pyrrol-2-ylShow More⌵
Mol. Formula:
C26H34N4O4
M.W.:
466.58
Type:
Unknown
AlogP:
3.30
Polar Surface Area:
103.53
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4799580 Name:
(Z)-N-(3-(Dimethylamino)propyl)-5-((5-fluoro-2-oxoindolin-3-ylidene)methyl)Show More⌵
Mol. Formula:
C21H25FN4O2
M.W.:
384.46
Type:
Unknown
AlogP:
2.94
Polar Surface Area:
77.23
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4796639 Name:
(Z)-5-((5-((2-Azidoethyl)-2-oxoindolin-3-ylidene)methyl)-N-(2-(diethylaminoShow More⌵
Mol. Formula:
C24H31N7O2
M.W.:
449.56
Type:
Unknown
AlogP:
4.05
Polar Surface Area:
125.99
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA4795455 Name:
(Z)-5-((5-Fluoro-2-oxoindolin-3-ylidene)methyl)-2,4-dimethyl-N-propyl-1H-pyShow More⌵
Mol. Formula:
C19H20FN3O2
M.W.:
341.39
Type:
Unknown
AlogP:
3.40
Polar Surface Area:
73.99
HBA:
2
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA4795330 Name:
(Z)-5-((5-(2-Acetamidoethyl)-2-oxoindolin-3-ylidene)methyl)-N-(2-(diethylamShow More⌵
Mol. Formula:
C26H35N5O3
M.W.:
465.60
Type:
Unknown
AlogP:
2.87
Polar Surface Area:
106.33
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4794096 Name:
(Z)-5-((5-Cyano-2-oxoindolin-3-ylidene)methyl)-N-(2-(diethylamino)ethyl)-2,Show More⌵
Mol. Formula:
C23H27N5O2
M.W.:
405.50
Type:
Unknown
AlogP:
3.07
Polar Surface Area:
101.02
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA4792246 Name:
(Z)-N-(2-(Diethylamino)ethyl)-2,4-dimethyl-5-((2-oxo-5-(ureidomethyl)indoliShow More⌵
Mol. Formula:
C24H32N6O3
M.W.:
452.56
Type:
Unknown
AlogP:
2.36
Polar Surface Area:
132.35
HBA:
4
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4788980 Name:
(Z)-N-(3-(Diethylamino)propyl)-5-((5-fluoro-2-oxoindolin-3-ylidene)methyl)-Show More⌵
Mol. Formula:
C23H29FN4O2
M.W.:
412.51
Type:
Unknown
AlogP:
3.73
Polar Surface Area:
77.23
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4788376 Name:
(Z)-5-((5-(2-cyanoethyl)-2-oxoindolin-3-ylidene)methyl)-N-(2-(diethylamino)Show More⌵
Mol. Formula:
C25H31N5O2
M.W.:
433.56
Type:
Unknown
AlogP:
3.65
Polar Surface Area:
101.02
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4786972 Name:
(Z)-5-((6-Chloro-2-oxoindolin-3-ylidene)methyl)-N-(2-(diethylamino)ethyl)-2Show More⌵
Mol. Formula:
C22H27ClN4O2
M.W.:
414.94
Type:
Unknown
AlogP:
3.85
Polar Surface Area:
77.23
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA4785831 Name:
(Z)-N-(2-(Diethylamino)ethyl)-5-((6-ethyl-2-oxoindolin-3-ylidene)methyl)-2,Show More⌵
Mol. Formula:
C24H32N4O2
M.W.:
408.55
Type:
Unknown
AlogP:
3.76
Polar Surface Area:
77.23
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4782796 Name:
(Z)-5-((6-Bromo-2-oxoindolin-3-ylidene)methyl)-N-(2-(diethylamino)ethyl)-2,Show More⌵
Mol. Formula:
C22H27BrN4O2
M.W.:
459.39
Type:
Unknown
AlogP:
3.96
Polar Surface Area:
77.23
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4781578 Name:
(Z)-5-((5-(3-Amino-3-oxopropyl)-2-oxoindolin-3-ylidene)methyl)-N-(2-(diethyShow More⌵
Mol. Formula:
C25H33N5O3
M.W.:
451.57
Type:
Unknown
AlogP:
2.61
Polar Surface Area:
120.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4781062 Name:
(Z)-N-(2-(Diethylamino)ethyl)-5-((5-(2-methoxyethyl)-2-oxoindolin-3-ylideneShow More⌵
Mol. Formula:
C25H34N4O3
M.W.:
438.57
Type:
Unknown
AlogP:
3.38
Polar Surface Area:
86.46
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4779730 Name:
(Z)-N-(2-(Diethylamino)ethyl)-5-((5-(2-(dimethylamino)ethyl)-2-oxoindolin-3Show More⌵
Mol. Formula:
C26H37N5O2
M.W.:
451.62
Type:
Unknown
AlogP:
3.30
Polar Surface Area:
80.47
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4779166 Name:
(Z)-N-(2-(Diethylamino)ethyl)-5-((6-fluoro-2-oxoindolin-3-ylidene)methyl)-2Show More⌵
Mol. Formula:
C22H27FN4O2
M.W.:
398.48
Type:
Unknown
AlogP:
3.33
Polar Surface Area:
77.23
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4114389 Name:
US9187477, 8
Mol. Formula:
C28H33ClN4O6
M.W.:
557.05
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/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
Small molecule
AlogP:
4.35
Polar Surface Area:
127.82
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4114379 Name:
US9187477, 14
Mol. Formula:
C27H32ClN5O6
M.W.:
558.04
Type:
Small molecule
AlogP:
3.29
Polar Surface Area:
131.06
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
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