| Collection |
D4 : TTD |
| Chemical Name |
TD-1211 ( From PubChem : A X E L O P R A N ) |
| 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 |
| 457.606 g/mol |
3 |
7 |
2.8962 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 6 H 3 9 N 3 O 4 / c 2 7 - 2 5 ( 3 2 ) 2 0 - 8 - 4 - 7 - 1 9 ( 1 3 - 2 0 ) 2 1 - 1 4 - 2 2 - 9 - 1 0 - 2 3 ( 1 5 - 2 1 ) 2 9 ( 2 2 ) 1 2 - 1 1 - 2 8 ( 2 6 ( 3 3 ) 2 4 ( 3 1 ) 1 7 - 3 0 ) 1 6 - 1 8 - 5 - 2 - 1 - 3 - 6 - 1 8 / h 4 , 7 - 8 , 1 3 , 1 8 , 2 1 - 2 4 , 3 0 - 3 1 H , 1 - 3 , 5 - 6 , 9 - 1 2 , 1 4 - 1 7 H 2 , ( H 2 , 2 7 , 3 2 ) / t 2 1 - , 2 2 - , 2 3 + , 2 4 - / m 0 / s 1 |
| InChIKey |
A T L Y L V P Z N W D J B W - X Q U A L C H D S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | OPRM1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
