Compounds

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ALA2269106
Name:
4-hydroxy-2-methoxy-2H-benzo[b][1,4]oxazin-3(4H)-o
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Cas Number:
55574-10-2

Mol. Formula:
C9H9NO4
M.W.:
195.17

4 activity values

3 unique targets
Type:
Small molecule
AlogP:
0.77
Polar Surface Area:
59.00
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA2269105
Name:
4-hydroxy-3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazin
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Mol. Formula:
C9H7NO5
M.W.:
209.16

1 activity values

1 unique targets
Type:
Small molecule
AlogP:
0.50
Polar Surface Area:
87.07
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA2269103
Name:
4-hydroxy-2,7-dimethoxy-2H-benzo[b][1,4]oxazin-3(4
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Cas Number:
55544-90-6

Mol. Formula:
C10H11NO5
M.W.:
225.20

1 activity values

1 unique targets
Type:
Small molecule
AlogP:
0.78
Polar Surface Area:
68.23
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA2269101
Name:
2,4-dihydroxy-7-methoxy-2H-benzo[b][1,4]oxazin-3(4
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Cas Number:
15893-52-4

Mol. Formula:
C9H9NO5
M.W.:
211.17

5 activity values

4 unique targets
Type:
Small molecule
AlogP:
0.13
Polar Surface Area:
79.23
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA2268880
Name:
Galangustin

Mol. Formula:
C17H14O6
M.W.:
314.29

11 activity values

7 unique targets
Type:
Small molecule
AlogP:
2.89
Polar Surface Area:
89.13
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE