Compounds

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ALA2448556
Name:
1-Methyl-1H-indazole-3-carboxylic acid (8-methyl-8-aza-bicyclo[3.2.1]oct-3-Show More⌵
Mol. Formula:
C17H22N4O
M.W.:
298.39

Type:
Small molecule
AlogP:
1.93
Polar Surface Area:
50.16
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.92
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1-Desmethyl Granisetron (Granisetron Impurity B)
Name:
1H-Indazole-3-carboxylic acid (9-methyl-9-aza-bicyclo[3.3.1]non-3-yl)-amide
Mol. Formula:
C17H22N4O
M.W.:
298.39
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
2.31
Polar Surface Area:
61.02
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.89
DETAILS
CLOSE
ALA285999
Name:
3,3-Dimethyl-2,3-dihydro-indole-1-carboxylic acid (8-methyl-8-aza-bicyclo[3Show More⌵
Mol. Formula:
C19H27N3O
M.W.:
313.44
8 activity values
5 unique targets
Type:
Small molecule
AlogP:
3.12
Polar Surface Area:
35.58
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.86
DETAILS
CLOSE