Compounds

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ALA510099
Name:
2-chloro-6-(3-methoxyanilino)-9-isopropylpurine
Mol. Formula:
C15H16ClN5O
M.W.:
317.78
6 activity values
6 unique targets
Type:
Small molecule
AlogP:
3.81
Polar Surface Area:
64.86
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
ALA520495
Name:
2-Chloro-6-(3-methoxyanilino)-9-methylpurine
Mol. Formula:
C13H12ClN5O
M.W.:
289.73
6 activity values
6 unique targets
Type:
Small molecule
AlogP:
2.77
Polar Surface Area:
64.86
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA484570
Name:
2-Methylthio-6-(3-methoxyanilino)purine
Mol. Formula:
C13H13N5OS
M.W.:
287.35
6 activity values
6 unique targets
Type:
Small molecule
AlogP:
2.83
Polar Surface Area:
75.72
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA446025
Name:
2-Amino-6-(3-methoxyanilino)purine
Mol. Formula:
C12H12N6O
M.W.:
256.27
6 activity values
6 unique targets
Type:
Small molecule
AlogP:
1.69
Polar Surface Area:
101.74
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA484389
Name:
2-Nitro-6-(3-methoxyanilino)purine
Mol. Formula:
C12H10N6O3
M.W.:
286.25
6 activity values
6 unique targets
Type:
Small molecule
AlogP:
2.01
Polar Surface Area:
118.86
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE