| Collection |
D4 : TTD |
| Chemical Name |
EUGENIIN ( From PubChem : E U G E N I I N ) |
| 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 |
| 938.661 g/mol |
15 |
26 |
1.6665 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 4 1 H 3 0 O 2 6 / c 4 2 - 1 5 - 1 - 1 0 ( 2 - 1 6 ( 4 3 ) 2 6 ( 1 5 ) 5 0 ) 3 6 ( 5 7 ) 6 5 - 3 4 - 3 3 - 2 3 ( 9 - 6 2 - 3 9 ( 6 0 ) 1 3 - 7 - 2 1 ( 4 8 ) 2 9 ( 5 3 ) 3 1 ( 5 5 ) 2 4 ( 1 3 ) 2 5 - 1 4 ( 4 0 ( 6 1 ) 6 4 - 3 3 ) 8 - 2 2 ( 4 9 ) 3 0 ( 5 4 ) 3 2 ( 2 5 ) 5 6 ) 6 3 - 4 1 ( 6 7 - 3 8 ( 5 9 ) 1 2 - 5 - 1 9 ( 4 6 ) 2 8 ( 5 2 ) 2 0 ( 4 7 ) 6 - 1 2 ) 3 5 ( 3 4 ) 6 6 - 3 7 ( 5 8 ) 1 1 - 3 - 1 7 ( 4 4 ) 2 7 ( 5 1 ) 1 8 ( 4 5 ) 4 - 1 1 / h 1 - 8 , 2 3 , 3 3 - 3 5 , 4 1 - 5 6 H , 9 H 2 / t 2 3 ? , 3 3 ? , 3 4 - , 3 5 + , 4 1 - / m 0 / s 1 |
| InChIKey |
J C G H A E B I B S E Q A D - F R E Z N Z T B S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | SQLE | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
