| Collection |
D4 : TTD |
| Chemical Name |
Tonazocine mesylate ( From PubChem : T O N A Z O C I N E M E S Y L A T E ) |
| 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 |
| 453.635 g/mol |
2 |
6 |
5.3687 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 3 H 3 5 N O 2 . C H 4 O 3 S / c 1 - 5 - 6 - 7 - 8 - 1 8 ( 2 5 ) 1 1 - 1 2 - 2 3 ( 3 ) 2 1 - 1 5 - 1 7 - 9 - 1 0 - 1 9 ( 2 6 ) 1 6 - 2 0 ( 1 7 ) 2 2 ( 2 3 , 2 ) 1 3 - 1 4 - 2 4 ( 2 1 ) 4 ; 1 - 5 ( 2 , 3 ) 4 / h 9 - 1 0 , 1 6 , 2 1 , 2 6 H , 5 - 8 , 1 1 - 1 5 H 2 , 1 - 4 H 3 ; 1 H 3 , ( H , 2 , 3 , 4 ) |
| InChIKey |
C Q S T V P Y A R Y S B N S - U H F F F A O Y S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Agonist | OPRD1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
