| Collection |
D4 : TTD |
| Chemical Name |
domoric acid ( From PubChem : D O M O R I C A C I D ) |
| 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 |
| 311.33 g/mol |
4 |
7 |
1.3019 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 5 H 2 1 N O 6 / c 1 - 8 ( 4 - 3 - 5 - 9 ( 2 ) 1 4 ( 1 9 ) 2 0 ) 1 1 - 7 - 1 6 - 1 3 ( 1 5 ( 2 1 ) 2 2 ) 1 0 ( 1 1 ) 6 - 1 2 ( 1 7 ) 1 8 / h 3 - 5 , 9 - 1 1 , 1 3 , 1 6 H , 6 - 7 H 2 , 1 - 2 H 3 , ( H , 1 7 , 1 8 ) ( H , 1 9 , 2 0 ) ( H , 2 1 , 2 2 ) / b 5 - 3 + , 8 - 4 + / t 9 - , 1 0 + , 1 1 - , 1 3 + / m 1 / s 1 |
| InChIKey |
V Z F R N C S O C O P N D B - J I U S A D R U S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | GRIK1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
