| Collection |
D4 : TTD |
| Chemical Name |
DwFwLL-NH2 ( From PubChem : C H E M B L 4 4 9 5 9 0 ) |
| 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 |
| 878.027 g/mol |
10 |
15 |
5.8357 |
False(0/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 4 7 H 5 9 N 9 O 8 / c 1 - 2 6 ( 2 ) 1 8 - 3 6 ( 4 2 ( 4 9 ) 5 9 ) 5 2 - 4 4 ( 6 1 ) 3 7 ( 1 9 - 2 7 ( 3 ) 4 ) 5 4 - 4 7 ( 6 4 ) 4 0 ( 2 2 - 3 0 - 2 5 - 5 1 - 3 5 - 1 7 - 1 1 - 9 - 1 5 - 3 2 ( 3 0 ) 3 5 ) 5 6 - 4 5 ( 6 2 ) 3 8 ( 2 0 - 2 8 - 1 2 - 6 - 5 - 7 - 1 3 - 2 8 ) 5 5 - 4 6 ( 6 3 ) 3 9 ( 5 3 - 4 3 ( 6 0 ) 3 3 ( 4 8 ) 2 3 - 4 1 ( 5 7 ) 5 8 ) 2 1 - 2 9 - 2 4 - 5 0 - 3 4 - 1 6 - 1 0 - 8 - 1 4 - 3 1 ( 2 9 ) 3 4 / h 5 - 1 7 , 2 4 - 2 7 , 3 3 , 3 6 - 4 0 , 5 0 - 5 1 H , 1 8 - 2 3 , 4 8 H 2 , 1 - 4 H 3 , ( H 2 , 4 9 , 5 9 ) ( H , 5 2 , 6 1 ) ( H , 5 3 , 6 0 ) ( H , 5 4 , 6 4 ) ( H , 5 5 , 6 3 ) ( H , 5 6 , 6 2 ) ( H , 5 7 , 5 8 ) / t 3 3 - , 3 6 - , 3 7 - , 3 8 - , 3 9 + , 4 0 + / m 0 / s 1 |
| InChIKey |
A Y Y V H E G P W N Z V T O - Y A Q H V W C Z S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | GHSR | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
