Compounds

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ALA4441793
Name:
3-(2,6-dihydroxyphenyl)-7-hydroxy-5-methylisobenzo
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Cas Number:
479350-63-5

Mol. Formula:
C15H12O5
M.W.:
272.26

1 activity values

1 unique targets
Type:
Unknown
AlogP:
2.37
Polar Surface Area:
86.99
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.69
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ALA2252293
Name:
5-benzyl-6-thioxo-6,7-dihydro-1H-pyrazolo[3,4-d]py
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Mol. Formula:
C12H10N4OS
M.W.:
258.31

10 activity values

3 unique targets
Type:
Small molecule
AlogP:
1.83
Polar Surface Area:
66.47
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
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ALA105809
Name:
2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]
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Cas Number:
57837-19-1

Mol. Formula:
C15H21NO4
M.W.:
279.34

97 activity values

23 unique targets
Type:
Small molecule
AlogP:
1.84
Polar Surface Area:
55.84
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE