Compounds

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ALA401798
Name:
6,7,7a,8-Tetrahydro-5H-benzo[g][1,3]dioxolo[4',5':4,5]benzo[1,2,3-de]quinolShow More⌵
Mol. Formula:
C17H15NO2
M.W.:
265.31
38 activity values
24 unique targets
Type:
Small molecule
AlogP:
2.83
Polar Surface Area:
30.49
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
Y
QED Weighted:
0.79
DETAILS
CLOSE
Glaucine
Name:
1,2,9,10-Tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinShow More⌵
Mol. Formula:
C21H25NO4
M.W.:
355.43
44 activity values
22 unique targets
Type:
Small molecule
AlogP:
3.47
Polar Surface Area:
40.16
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA36496
Name:
1,2-Dimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline
Mol. Formula:
C18H19NO2
M.W.:
281.36
3 activity values
3 unique targets
Type:
Small molecule
AlogP:
3.11
Polar Surface Area:
30.49
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.92
DETAILS
CLOSE
ALA36654
Name:
7-Methyl-6,7,7a,8-tetrahydro-5H-benzo[g][1,3]dioxolo[4',5':4,5]benzo[1,2,3-Show More⌵
Mol. Formula:
C18H17NO2
M.W.:
279.34
66 activity values
38 unique targets
Type:
Small molecule
AlogP:
3.17
Polar Surface Area:
21.70
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
Liriodenine
Name:
Benzo[g][1,3]dioxolo[4',5':4,5]benzo[1,2,3-de]quinolin-8-one
Mol. Formula:
C17H9NO3
M.W.:
275.26
219 activity values
111 unique targets
Type:
Small molecule
AlogP:
3.17
Polar Surface Area:
48.42
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE