| Collection |
D4 : TTD |
| Chemical Name |
(-)-isoelaeocarpiline ( From PubChem : ( - ) - I S O E L A E O C A R P I L I N 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 |
| 259.343 g/mol |
0 |
3 |
2.2266 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 6 H 2 1 N O 2 / c 1 - 1 0 - 4 - 2 - 6 - 1 2 - 1 4 ( 1 0 ) 1 6 ( 1 8 ) 1 5 - 1 1 - 5 - 3 - 8 - 1 7 ( 1 1 ) 9 - 7 - 1 3 ( 1 5 ) 1 9 - 1 2 / h 2 , 6 , 1 0 - 1 1 , 1 3 , 1 5 H , 3 - 5 , 7 - 9 H 2 , 1 H 3 / t 1 0 - , 1 1 - , 1 3 + , 1 5 - / m 0 / s 1 |
| InChIKey |
R E T G X U C Y B M O W O H - M E D Z G J R S S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | OPRD1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
