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ALA5281044 Name:
3-(N-(3,4,5-trimethoxyphenyl)quinoline-8-sulfonamido)propyl 4-methylpiperazShow More⌵
Mol. Formula:
C27H34N4O5S3
M.W.:
590.79
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
4.11
Polar Surface Area:
84.44
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA5278433 Name:
3-(N-(3,4,5-trimethoxyphenyl)quinoline-8-sulfonamido)propyl 4-(2-hydroxyethShow More⌵
Mol. Formula:
C28H36N4O6S3
M.W.:
620.82
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
3.47
Polar Surface Area:
104.67
HBA:
10
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA5278238 Name:
3-(N-(3,4,5-trimethoxyphenyl)quinoline-8-sulfonamido)propyl 4-acetylpiperazShow More⌵
Mol. Formula:
C28H34N4O6S3
M.W.:
618.80
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
4.03
Polar Surface Area:
101.51
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA5273300 Name:
3-(N-(3,4,5-trimethoxyphenyl)quinoline-8-sulfonamido)propyl 4-ethylpiperaziShow More⌵
Mol. Formula:
C28H36N4O5S3
M.W.:
604.82
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
4.50
Polar Surface Area:
84.44
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA5196143 Name:
N-(5-(4-acetylpiperazin-1-yl)-2-((3-(3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-bShow More⌵
Mol. Formula:
C31H32N6O5
M.W.:
568.63
Type:
---
AlogP:
4.35
Polar Surface Area:
128.89
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA5205370 Name:
6-((2-acrylamidophenyl)amino)-N-(3,5-dimethoxyphenyl)-1H-pyrrolo[2,3-b]pyriShow More⌵
Mol. Formula:
C25H23N5O4
M.W.:
457.49
Type:
---
AlogP:
4.70
Polar Surface Area:
117.37
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA5203746 Name:
N-(2-((3-((3-methoxyphenyl)sulfonyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)amino)phShow More⌵
Mol. Formula:
C23H20N4O4S
M.W.:
448.50
Type:
---
AlogP:
4.27
Polar Surface Area:
113.18
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA5202643 Name:
N-(2-((3-(3,5-dimethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)amino)phenyl)aShow More⌵
Mol. Formula:
C24H22N4O3
M.W.:
414.47
Type:
---
AlogP:
5.12
Polar Surface Area:
88.27
HBA:
5
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA5201881 Name:
N-(2-((3-(3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)amino)-5-morpShow More⌵
Mol. Formula:
C29H29N5O5
M.W.:
527.58
Type:
---
AlogP:
4.52
Polar Surface Area:
117.81
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA5199418 Name:
N-(2-((3-(2,6-dichloro-3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)Show More⌵
Mol. Formula:
C29H24Cl2N6O4
M.W.:
591.46
Type:
---
AlogP:
6.39
Polar Surface Area:
123.16
HBA:
8
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA5199236 Name:
N-(2-((3-(3-methoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)amino)phenyl)acryShow More⌵
Mol. Formula:
C24H20N4O3
M.W.:
412.45
Type:
---
AlogP:
4.67
Polar Surface Area:
96.11
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA5208777 Name:
N-(2-((3-(3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)amino)-5-(4-mShow More⌵
Mol. Formula:
C30H32N6O4
M.W.:
540.62
Type:
---
AlogP:
4.43
Polar Surface Area:
111.82
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA5207111 Name:
N-(2-((3-((3-methoxyphenyl)sulfinyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)amino)phShow More⌵
Mol. Formula:
C23H20N4O3S
M.W.:
432.51
Type:
---
AlogP:
4.61
Polar Surface Area:
102.10
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA5195632 Name:
N-(2-((3-((3-methoxyphenyl)thio)-1H-pyrrolo[2,3-b]pyridin-6-yl)amino)phenylShow More⌵
Mol. Formula:
C23H20N4O2S
M.W.:
416.51
Type:
---
AlogP:
5.59
Polar Surface Area:
79.04
HBA:
5
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA5194417 Name:
N-(2-((3-(2,6-dichloro-3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)Show More⌵
Mol. Formula:
C25H20Cl2N4O4
M.W.:
511.37
Type:
---
AlogP:
5.99
Polar Surface Area:
105.34
HBA:
6
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA5193819 Name:
N-(2-((3-(2,6-dichloro-3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)Show More⌵
Mol. Formula:
C29H27Cl2N5O5
M.W.:
596.47
Type:
---
AlogP:
5.82
Polar Surface Area:
117.81
HBA:
8
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA5192936 Name:
N-(2-((3-(2,6-dichloro-3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)Show More⌵
Mol. Formula:
C28H26Cl2N4O6
M.W.:
585.44
Type:
---
AlogP:
6.01
Polar Surface Area:
123.80
HBA:
8
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.10
DETAILS
CLOSE
ALA5186333 Name:
N-(2-((3-(3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)amino)-5-(1-mShow More⌵
Mol. Formula:
C29H26N6O4
M.W.:
522.57
Type:
---
AlogP:
5.08
Polar Surface Area:
123.16
HBA:
8
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA5181530 Name:
N-(5-(4-acetylpiperazin-1-yl)-2-((3-(2,6-dichloro-3,5-dimethoxybenzoyl)-1H-Show More⌵
Mol. Formula:
C31H30Cl2N6O5
M.W.:
637.52
Type:
---
AlogP:
5.65
Polar Surface Area:
128.89
HBA:
8
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA5175947 Name:
N-(2-((3-(2,6-dichloro-3,5-dimethoxybenzoyl)-1H-pyrrolo[2,3-b]pyridin-6-yl)Show More⌵
Mol. Formula:
C30H30Cl2N6O4
M.W.:
609.51
Type:
---
AlogP:
5.74
Polar Surface Area:
111.82
HBA:
8
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
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