| Collection |
D4 : TTD |
| Chemical Name |
E-6-O-p-methoxycinnamoyl scandoside methyl ester ( From PubChem : C H E M B L 4 4 7 0 1 2 ) |
| 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 |
| 564.535 g/mol |
5 |
13 |
-0.9854 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 7 H 3 2 O 1 3 / c 1 - 3 5 - 1 5 - 6 - 3 - 1 3 ( 4 - 7 - 1 5 ) 5 - 8 - 1 9 ( 3 0 ) 3 8 - 1 7 - 9 - 1 4 ( 1 0 - 2 8 ) 2 0 - 2 1 ( 1 7 ) 1 6 ( 2 5 ( 3 4 ) 3 6 - 2 ) 1 2 - 3 7 - 2 6 ( 2 0 ) 4 0 - 2 7 - 2 4 ( 3 3 ) 2 3 ( 3 2 ) 2 2 ( 3 1 ) 1 8 ( 1 1 - 2 9 ) 3 9 - 2 7 / h 3 - 9 , 1 2 , 1 7 - 1 8 , 2 0 - 2 4 , 2 6 - 2 9 , 3 1 - 3 3 H , 1 0 - 1 1 H 2 , 1 - 2 H 3 / b 8 - 5 + / t 1 7 - , 1 8 - , 2 0 - , 2 1 + , 2 2 - , 2 3 + , 2 4 - , 2 6 + , 2 7 + / m 1 / s 1 |
| InChIKey |
V B H B N H X Z B K W Q N O - B I I Y M W G F S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ELANE | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
