| Collection |
D4 : TTD |
| Chemical Name |
H-Tyr-D-Ala-Gly-Phe-Pro-Leu-Trp-NH-Bzl ( From PubChem : C H E M B L 2 7 1 6 1 9 ) |
| 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 |
| 942.112 g/mol |
9 |
16 |
5.6411 |
False(0/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 5 2 H 6 3 N 9 O 8 / c 1 - 3 2 ( 2 ) 2 5 - 4 2 ( 5 0 ( 6 7 ) 5 9 - 4 3 ( 4 9 ( 6 6 ) 5 5 - 2 9 - 3 6 - 1 5 - 8 - 5 - 9 - 1 6 - 3 6 ) 2 8 - 3 7 - 3 0 - 5 4 - 4 1 - 1 8 - 1 1 - 1 0 - 1 7 - 3 9 ( 3 7 ) 4 1 ) 6 0 - 5 1 ( 6 8 ) 4 5 - 1 9 - 1 2 - 2 4 - 6 1 ( 4 5 ) 5 2 ( 6 9 ) 4 4 ( 2 7 - 3 4 - 1 3 - 6 - 4 - 7 - 1 4 - 3 4 ) 5 8 - 4 6 ( 6 3 ) 3 1 - 5 6 - 4 7 ( 6 4 ) 3 3 ( 3 ) 5 7 - 4 8 ( 6 5 ) 4 0 ( 5 3 ) 2 6 - 3 5 - 2 0 - 2 2 - 3 8 ( 6 2 ) 2 3 - 2 1 - 3 5 / h 4 - 1 1 , 1 3 - 1 8 , 2 0 - 2 3 , 3 0 , 3 2 - 3 3 , 4 0 , 4 2 - 4 5 , 5 4 , 6 2 H , 1 2 , 1 9 , 2 4 - 2 9 , 3 1 , 5 3 H 2 , 1 - 3 H 3 , ( H , 5 5 , 6 6 ) ( H , 5 6 , 6 4 ) ( H , 5 7 , 6 5 ) ( H , 5 8 , 6 3 ) ( H , 5 9 , 6 7 ) ( H , 6 0 , 6 8 ) / t 3 3 - , 4 0 + , 4 2 + , 4 3 + , 4 4 + , 4 5 + / m 1 / s 1 |
| InChIKey |
V X H M I T A K W Y I I L S - F D X P N M I T S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | TACR1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
