| Collection |
D4 : TTD |
| Chemical Name |
Des-AA1,2,5-[D-Nal8,IAmp9,(NalphaMe)Ser13]SRIF ( From PubChem : C H E M B L 2 6 4 8 3 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 |
| 1510.82 g/mol |
16 |
30 |
5.4197 |
False(0/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 7 7 H 9 9 N 1 3 O 1 5 S 2 / c 1 - 4 5 ( 2 ) 8 0 - 4 1 - 5 2 - 3 0 - 2 8 - 5 1 ( 2 9 - 3 1 - 5 2 ) 3 9 - 6 0 - 7 2 ( 9 9 ) 8 8 - 6 5 ( 4 6 ( 3 ) 9 2 ) 7 5 ( 1 0 2 ) 8 6 - 6 1 ( 3 8 - 5 0 - 2 3 - 1 3 - 8 - 1 4 - 2 4 - 5 0 ) 7 3 ( 1 0 0 ) 8 9 - 6 6 ( 4 7 ( 4 ) 9 3 ) 7 6 ( 1 0 3 ) 9 0 ( 5 ) 6 4 ( 4 2 - 9 1 ) 7 4 ( 1 0 1 ) 8 7 - 6 3 ( 7 7 ( 1 0 4 ) 1 0 5 ) 4 4 - 1 0 7 - 1 0 6 - 4 3 - 5 6 ( 7 9 ) 6 7 ( 9 4 ) 8 1 - 5 7 ( 2 7 - 1 7 - 1 8 - 3 4 - 7 8 ) 6 8 ( 9 5 ) 8 2 - 5 8 ( 3 6 - 4 8 - 1 9 - 9 - 6 - 1 0 - 2 0 - 4 8 ) 6 9 ( 9 6 ) 8 3 - 5 9 ( 3 7 - 4 9 - 2 1 - 1 1 - 7 - 1 2 - 2 2 - 4 9 ) 7 0 ( 9 7 ) 8 5 - 6 2 ( 7 1 ( 9 8 ) 8 4 - 6 0 ) 4 0 - 5 3 - 3 2 - 3 3 - 5 4 - 2 5 - 1 5 - 1 6 - 2 6 - 5 5 ( 5 4 ) 3 5 - 5 3 / h 6 - 1 6 , 1 9 - 2 6 , 2 8 - 3 3 , 3 5 , 4 5 - 4 7 , 5 6 - 6 6 , 8 0 , 9 1 - 9 3 H , 1 7 - 1 8 , 2 7 , 3 4 , 3 6 - 4 4 , 7 8 - 7 9 H 2 , 1 - 5 H 3 , ( H , 8 1 , 9 4 ) ( H , 8 2 , 9 5 ) ( H , 8 3 , 9 6 ) ( H , 8 4 , 9 8 ) ( H , 8 5 , 9 7 ) ( H , 8 6 , 1 0 2 ) ( H , 8 7 , 1 0 1 ) ( H , 8 8 , 9 9 ) ( H , 8 9 , 1 0 0 ) ( H , 1 0 4 , 1 0 5 ) / t 4 6 - , 4 7 - , 5 6 - , 5 7 - , 5 8 - , 5 9 + , 6 0 + , 6 1 + , 6 2 + , 6 3 + , 6 4 + , 6 5 ? , 6 6 ? / m 1 / s 1 |
| InChIKey |
X J Z Z H U H C S Z M Q G G - G M W D E K S X S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | SSTR1 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
