Compounds

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ALA4295236
Name:
N-(5-(benzyloxy)-3-cyano-1H-indol-2-yl)pivalamide
Mol. Formula:
C21H21N3O2
M.W.:
347.42
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
4.60
Polar Surface Area:
77.91
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
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ALA4295161
Name:
2-amino-N-(4-(2-amino-3-cyano-1-(cyclopropylmethyl)-1H-indol-5-yloxy)phenylShow More⌵
Mol. Formula:
C21H21N5O2
M.W.:
375.43
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
3.19
Polar Surface Area:
119.09
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
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ALA4287966
Name:
2-amino-N-(3-((2-amino-3-cyano-1-methyl-1H-indol-5-yloxy)methyl)phenyl)-3-hShow More⌵
Mol. Formula:
C20H21N5O3
M.W.:
379.42
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
1.47
Polar Surface Area:
139.32
HBA:
7
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4284586
Name:
2-amino-5-(benzyloxy)-1-methyl-1H-indole-3-carbonitrile
Mol. Formula:
C17H15N3O
M.W.:
277.33
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
3.21
Polar Surface Area:
63.97
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA4281164
Name:
2-amino-5-(3-aminobenzyloxy)-1-methyl-1H-indole-3-carbonitrile
Mol. Formula:
C17H16N4O
M.W.:
292.34
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
2.79
Polar Surface Area:
89.99
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA4280063
Name:
2-amino-5-(benzyloxy)-1H-indole-3-carbonitrile
Mol. Formula:
C16H13N3O
M.W.:
263.30
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
3.20
Polar Surface Area:
74.83
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA4279997
Name:
2-amino-N-(4-(2-amino-1-(2-amino-2-oxoethyl)-3-cyano-1H-indol-5-yloxy)phenyShow More⌵
Mol. Formula:
C19H18N6O3
M.W.:
378.39
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
1.27
Polar Surface Area:
162.18
HBA:
7
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE