| Collection |
D4 : TTD |
| Chemical Name |
Boc-Tyr(SO3H)-Nle-Gly-Trp-Nle-Asp-Phe-NH2 ( From PubChem : C H E M B L 3 8 4 0 3 5 ) |
| 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 |
| 1092.22 g/mol |
11 |
23 |
6.6687 |
False(0/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 5 2 H 6 9 N 9 O 1 5 S / c 1 - 6 - 8 - 1 8 - 3 7 ( 5 7 - 4 8 ( 6 8 ) 4 0 ( 6 1 - 5 1 ( 7 1 ) 7 5 - 5 2 ( 3 , 4 ) 5 ) 2 6 - 3 2 - 2 1 - 2 3 - 3 4 ( 2 4 - 2 2 - 3 2 ) 7 6 - 7 7 ( 7 2 , 7 3 ) 7 4 ) 4 6 ( 6 6 ) 5 5 - 3 0 - 4 3 ( 6 2 ) 5 6 - 4 1 ( 2 7 - 3 3 - 2 9 - 5 4 - 3 6 - 2 0 - 1 4 - 1 3 - 1 7 - 3 5 ( 3 3 ) 3 6 ) 4 9 ( 6 9 ) 5 8 - 3 8 ( 1 9 - 9 - 7 - 2 ) 4 7 ( 6 7 ) 6 0 - 4 2 ( 2 8 - 4 4 ( 6 3 ) 6 4 ) 5 0 ( 7 0 ) 5 9 - 3 9 ( 4 5 ( 5 3 ) 6 5 ) 2 5 - 3 1 - 1 5 - 1 1 - 1 0 - 1 2 - 1 6 - 3 1 / h 1 0 - 1 7 , 2 0 - 2 4 , 2 9 , 3 7 - 4 2 , 5 4 H , 6 - 9 , 1 8 - 1 9 , 2 5 - 2 8 , 3 0 H 2 , 1 - 5 H 3 , ( H 2 , 5 3 , 6 5 ) ( H , 5 5 , 6 6 ) ( H , 5 6 , 6 2 ) ( H , 5 7 , 6 8 ) ( H , 5 8 , 6 9 ) ( H , 5 9 , 7 0 ) ( H , 6 0 , 6 7 ) ( H , 6 1 , 7 1 ) ( H , 6 3 , 6 4 ) ( H , 7 2 , 7 3 , 7 4 ) / t 3 7 - , 3 8 - , 3 9 - , 4 0 - , 4 1 - , 4 2 - / m 0 / s 1 |
| InChIKey |
C S X I D Z J P J Y R G S K - U J K K Y Y S E S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CCKAR | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
