| Collection |
D4 : TTD |
| Chemical Name |
BIS(8)-HUPERZINE B ( From PubChem : B I S ( 8 ) - H U P E R Z I N E B ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Not | Not | Not | Not | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 680.879 g/mol |
2 |
8 |
3.4152 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 4 0 H 5 2 N 6 O 4 / c 1 - 2 5 - 1 7 - 2 7 - 1 9 - 3 3 - 3 1 ( 9 - 1 1 - 3 5 ( 4 7 ) 4 1 - 3 3 ) 3 9 ( 2 1 - 2 5 ) 2 9 ( 2 7 ) 7 - 5 - 1 3 - 4 5 ( 3 9 ) 3 7 ( 4 9 ) 2 3 - 4 3 ( 3 ) 1 5 - 1 6 - 4 4 ( 4 ) 2 4 - 3 8 ( 5 0 ) 4 6 - 1 4 - 6 - 8 - 3 0 - 2 8 - 1 8 - 2 6 ( 2 ) 2 2 - 4 0 ( 3 0 , 4 6 ) 3 2 - 1 0 - 1 2 - 3 6 ( 4 8 ) 4 2 - 3 4 ( 3 2 ) 2 0 - 2 8 / h 9 - 1 2 , 1 7 - 1 8 , 2 7 - 3 0 H , 5 - 8 , 1 3 - 1 6 , 1 9 - 2 4 H 2 , 1 - 4 H 3 , ( H , 4 1 , 4 7 ) ( H , 4 2 , 4 8 ) / t 2 7 - , 2 8 - , 2 9 + , 3 0 + , 3 9 + , 4 0 + / m 0 / s 1 |
| InChIKey |
C T E O P W R Y K G O S F E - J Q M X G A K R S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ACHE | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
