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ALA5285133 Name:
7-phenyl-N4-(p-tolyl)pyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
Mol. Formula:
C18H16N6
M.W.:
316.37
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
3.43
Polar Surface Area:
81.13
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA5271974 Name:
N4-(3-(dimethylamino)propyl)-7-phenylpyrazolo[1,5-a][1,3,5]triazine-2,4-diaShow More⌵
Mol. Formula:
C16H21N7
M.W.:
311.39
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
1.74
Polar Surface Area:
84.37
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA3769595 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H43FN6O2
M.W.:
574.75
Type:
Small molecule
AlogP:
4.99
Polar Surface Area:
84.57
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA3770508 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H43BrN6O2
M.W.:
635.65
Type:
Small molecule
AlogP:
5.61
Polar Surface Area:
84.57
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA3769931 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H43BrN6O2
M.W.:
635.65
Type:
Small molecule
AlogP:
5.61
Polar Surface Area:
84.57
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA3770694 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H43ClN6O2
M.W.:
591.20
Type:
Small molecule
AlogP:
5.50
Polar Surface Area:
84.57
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA3770331 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H43ClN6O2
M.W.:
591.20
Type:
Small molecule
AlogP:
5.50
Polar Surface Area:
84.57
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA3770217 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H43ClN6O2
M.W.:
591.20
Type:
Small molecule
AlogP:
5.50
Polar Surface Area:
84.57
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA3769822 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H44N6O2
M.W.:
556.76
Type:
Small molecule
AlogP:
4.85
Polar Surface Area:
84.57
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3770204 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C34H41F6N7O2
M.W.:
693.74
Type:
Small molecule
AlogP:
5.83
Polar Surface Area:
87.81
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA3769667 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H44FN7O4S
M.W.:
653.83
Type:
Small molecule
AlogP:
3.33
Polar Surface Area:
121.95
HBA:
7
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA3770496 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H44FN7O4S
M.W.:
653.83
Type:
Small molecule
AlogP:
3.33
Polar Surface Area:
121.95
HBA:
7
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA3771052 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C32H41F2N7O2
M.W.:
593.72
Type:
Small molecule
AlogP:
4.07
Polar Surface Area:
87.81
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3770666 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C32H41F2N7O2
M.W.:
593.72
Type:
Small molecule
AlogP:
4.07
Polar Surface Area:
87.81
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3770165 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C33H44ClN7O4S
M.W.:
670.28
Type:
Small molecule
AlogP:
3.85
Polar Surface Area:
121.95
HBA:
7
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA3769749 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C32H41Cl2N7O2
M.W.:
626.63
Type:
Small molecule
AlogP:
5.10
Polar Surface Area:
87.81
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA3770964 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C32H41Cl2N7O2
M.W.:
626.63
Type:
Small molecule
AlogP:
5.10
Polar Surface Area:
87.81
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA3769530 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C32H41Cl2N7O2
M.W.:
626.63
Type:
Small molecule
AlogP:
5.10
Polar Surface Area:
87.81
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA3770323 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C38H47N7O2
M.W.:
633.84
Type:
Small molecule
AlogP:
5.46
Polar Surface Area:
87.81
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA3771361 Name:
(R)-N-(1-(1,4'-bipiperidin-1'-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-Show More⌵
Mol. Formula:
C38H47N7O2
M.W.:
633.84
Type:
Small molecule
AlogP:
5.46
Polar Surface Area:
87.81
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
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