| Collection |
D4 : TTD |
| Chemical Name |
c[Nle-Asp-D-Phe-Arg-Trp-Glu]-NH2 ( From PubChem : C H E M B L 2 0 3 1 7 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 |
| 845.944 g/mol |
11 |
19 |
2.9332 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 4 1 H 5 5 N 1 1 O 9 / c 1 - 2 - 3 - 1 3 - 2 8 - 3 6 ( 5 7 ) 5 2 - 3 2 ( 2 1 - 3 4 ( 5 4 ) 5 5 ) 4 0 ( 6 1 ) 5 0 - 3 0 ( 1 9 - 2 3 - 1 0 - 5 - 4 - 6 - 1 1 - 2 3 ) 3 8 ( 5 9 ) 4 9 - 2 9 ( 1 5 - 9 - 1 8 - 4 5 - 4 1 ( 4 3 ) 4 4 ) 3 7 ( 5 8 ) 5 1 - 3 1 ( 2 0 - 2 4 - 2 2 - 4 6 - 2 6 - 1 4 - 8 - 7 - 1 2 - 2 5 ( 2 4 ) 2 6 ) 3 9 ( 6 0 ) 4 8 - 2 7 ( 3 5 ( 4 2 ) 5 6 ) 1 6 - 1 7 - 3 3 ( 5 3 ) 4 7 - 2 8 / h 4 - 8 , 1 0 - 1 2 , 1 4 , 2 2 , 2 7 - 3 2 , 4 6 H , 2 - 3 , 9 , 1 3 , 1 5 - 2 1 H 2 , 1 H 3 , ( H 2 , 4 2 , 5 6 ) ( H , 4 7 , 5 3 ) ( H , 4 8 , 6 0 ) ( H , 4 9 , 5 9 ) ( H , 5 0 , 6 1 ) ( H , 5 1 , 5 8 ) ( H , 5 2 , 5 7 ) ( H , 5 4 , 5 5 ) ( H 4 , 4 3 , 4 4 , 4 5 ) / t 2 7 - , 2 8 - , 2 9 - , 3 0 + , 3 1 - , 3 2 - / m 0 / s 1 |
| InChIKey |
H U A M I B C E K Z F Y S T - B C L K U R E P S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | MC4R | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
