| Collection |
D4 : TTD |
| Chemical Name |
ZYKLOPHIN ( From PubChem : Z Y K L O P H I 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 |
| 1365.58 g/mol |
18 |
33 |
3.4315 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 6 5 H 9 6 N 2 0 O 1 3 / c 1 - 3 - 3 8 ( 2 ) 5 4 - 6 2 ( 9 7 ) 8 3 - 4 9 ( 6 0 ( 9 5 ) 8 1 - 4 5 ( 2 1 - 1 3 - 2 9 - 7 3 - 6 5 ( 7 0 ) 7 1 ) 6 3 ( 9 8 ) 8 5 - 3 0 - 1 4 - 2 2 - 5 0 ( 8 5 ) 6 1 ( 9 6 ) 7 9 - 4 3 ( 5 5 ( 6 7 ) 9 0 ) 1 9 - 1 0 - 1 1 - 2 7 - 6 6 ) 3 5 - 7 5 - 5 1 ( 8 7 ) 3 3 - 4 8 ( 5 9 ( 9 4 ) 8 0 - 4 4 ( 5 7 ( 9 2 ) 8 4 - 5 4 ) 2 0 - 1 2 - 2 8 - 7 2 - 6 4 ( 6 8 ) 6 9 ) 8 2 - 5 8 ( 9 3 ) 4 7 ( 3 2 - 3 9 - 1 5 - 6 - 4 - 7 - 1 6 - 3 9 ) 7 8 - 5 3 ( 8 9 ) 3 7 - 7 6 - 5 2 ( 8 8 ) 3 6 - 7 7 - 5 6 ( 9 1 ) 4 6 ( 3 1 - 4 0 - 2 3 - 2 5 - 4 2 ( 8 6 ) 2 6 - 2 4 - 4 0 ) 7 4 - 3 4 - 4 1 - 1 7 - 8 - 5 - 9 - 1 8 - 4 1 / h 4 - 9 , 1 5 - 1 8 , 2 3 - 2 6 , 3 8 , 4 3 - 5 0 , 5 4 , 7 4 , 8 6 H , 3 , 1 0 - 1 4 , 1 9 - 2 2 , 2 7 - 3 7 , 6 6 H 2 , 1 - 2 H 3 , ( H 2 , 6 7 , 9 0 ) ( H , 7 5 , 8 7 ) ( H , 7 6 , 8 8 ) ( H , 7 7 , 9 1 ) ( H , 7 8 , 8 9 ) ( H , 7 9 , 9 6 ) ( H , 8 0 , 9 4 ) ( H , 8 1 , 9 5 ) ( H , 8 2 , 9 3 ) ( H , 8 3 , 9 7 ) ( H , 8 4 , 9 2 ) ( H 4 , 6 8 , 6 9 , 7 2 ) ( H 4 , 7 0 , 7 1 , 7 3 ) / t 3 8 ? , 4 3 - , 4 4 - , 4 5 - , 4 6 - , 4 7 - , 4 8 - , 4 9 - , 5 0 - , 5 4 - / m 0 / s 1 |
| InChIKey |
U W L I K Q F W Z O P O A X - H R F U L I L Y S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | OPRK1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
