| Collection |
D4 : Boss |
| Chemical Name |
eunades ( From PubChem : V I N O R E L B I N E ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Approved | Not | Not | Not | Approved | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 778.932 g/mol |
2 |
11 |
4.6944 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 4 5 H 5 4 N 4 O 8 / c 1 - 8 - 2 7 - 1 9 - 2 8 - 2 2 - 4 4 ( 4 0 ( 5 1 ) 5 5 - 6 , 3 6 - 3 0 ( 2 5 - 4 8 ( 2 3 - 2 7 ) 2 4 - 2 8 ) 2 9 - 1 3 - 1 0 - 1 1 - 1 4 - 3 3 ( 2 9 ) 4 6 - 3 6 ) 3 2 - 2 0 - 3 1 - 3 4 ( 2 1 - 3 5 ( 3 2 ) 5 4 - 5 ) 4 7 ( 4 ) 3 8 - 4 3 ( 3 1 ) 1 6 - 1 8 - 4 9 - 1 7 - 1 2 - 1 5 - 4 2 ( 9 - 2 , 3 7 ( 4 3 ) 4 9 ) 3 9 ( 5 7 - 2 6 ( 3 ) 5 0 ) 4 5 ( 3 8 , 5 3 ) 4 1 ( 5 2 ) 5 6 - 7 / h 1 0 - 1 5 , 1 9 - 2 1 , 2 8 , 3 7 - 3 9 , 4 6 , 5 3 H , 8 - 9 , 1 6 - 1 8 , 2 2 - 2 5 H 2 , 1 - 7 H 3 / t 2 8 ? , 3 7 ? , 3 8 ? , 3 9 - , 4 2 - , 4 3 - , 4 4 + , 4 5 + / m 1 / s 1 |
| InChIKey |
G B A B O Y U K A B K I A F - N R B J Q I M P S A - N
|
| Links |
|
Gene
(16 /
17)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
