| Collection |
D4 : TTD |
| Chemical Name |
Ac-Cys-Ile-Tyr-Lys-Phe(4-NO2)-Tyr-Phe ( From PubChem : C H E M B L 4 1 1 7 5 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 |
| 1070.22 g/mol |
12 |
20 |
5.8394 |
False(0/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 5 3 H 6 7 N 9 O 1 3 S / c 1 - 4 - 3 1 ( 2 ) 4 6 ( 6 1 - 5 1 ( 7 0 ) 4 5 ( 3 0 - 7 6 ) 5 5 - 3 2 ( 3 ) 6 3 ) 5 2 ( 7 1 ) 5 9 - 4 3 ( 2 8 - 3 6 - 1 7 - 2 3 - 3 9 ( 6 5 ) 2 4 - 1 8 - 3 6 ) 4 8 ( 6 7 ) 5 6 - 4 0 ( 1 2 - 8 - 9 - 2 5 - 5 4 ) 4 7 ( 6 6 ) 5 7 - 4 1 ( 2 6 - 3 4 - 1 3 - 1 9 - 3 7 ( 2 0 - 1 4 - 3 4 ) 6 2 ( 7 4 ) 7 5 ) 4 9 ( 6 8 ) 5 8 - 4 2 ( 2 7 - 3 5 - 1 5 - 2 1 - 3 8 ( 6 4 ) 2 2 - 1 6 - 3 5 ) 5 0 ( 6 9 ) 6 0 - 4 4 ( 5 3 ( 7 2 ) 7 3 ) 2 9 - 3 3 - 1 0 - 6 - 5 - 7 - 1 1 - 3 3 / h 5 - 7 , 1 0 - 1 1 , 1 3 - 2 4 , 3 1 , 4 0 - 4 6 , 6 4 - 6 5 , 7 6 H , 4 , 8 - 9 , 1 2 , 2 5 - 3 0 , 5 4 H 2 , 1 - 3 H 3 , ( H , 5 5 , 6 3 ) ( H , 5 6 , 6 7 ) ( H , 5 7 , 6 6 ) ( H , 5 8 , 6 8 ) ( H , 5 9 , 7 1 ) ( H , 6 0 , 6 9 ) ( H , 6 1 , 7 0 ) ( H , 7 2 , 7 3 ) / t 3 1 ? , 4 0 - , 4 1 - , 4 2 - , 4 3 - , 4 4 - , 4 5 - , 4 6 - / m 0 / s 1 |
| InChIKey |
N Y G F M H J K D B N T F T - G L N K E J A V S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | SRC | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
