| Collection |
D4 : TTD |
| Chemical Name |
MDL-74156 ( From PubChem : M D L 7 4 1 5 6 ) |
| 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 |
| 326.39 g/mol |
2 |
4 |
2.2487 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 9 H 2 2 N 2 O 3 / c 2 2 - 1 8 - 1 0 - 2 1 - 1 2 - 5 - 1 1 ( 1 8 ) 6 - 1 3 ( 2 1 ) 8 - 1 4 ( 7 - 1 2 ) 2 4 - 1 9 ( 2 3 ) 1 6 - 9 - 2 0 - 1 7 - 4 - 2 - 1 - 3 - 1 5 ( 1 6 ) 1 7 / h 1 - 4 , 9 , 1 1 - 1 4 , 1 8 , 2 0 , 2 2 H , 5 - 8 , 1 0 H 2 / t 1 1 - , 1 2 + , 1 3 - , 1 4 + , 1 8 - / m 1 / s 1 |
| InChIKey |
M L W G A E V S W J X O Q J - R R L O C T A F S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | KCNH2 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
