| Collection |
D4 : TTD |
| Chemical Name |
GFPDGG ( From PubChem : C H E M B L 2 6 1 6 2 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 |
| 548.546 g/mol |
7 |
15 |
-0.8581 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 4 H 3 2 N 6 O 9 / c 2 5 - 1 1 - 1 8 ( 3 1 ) 2 8 - 1 6 ( 9 - 1 4 - 5 - 2 - 1 - 3 - 6 - 1 4 ) 2 4 ( 3 9 ) 3 0 - 8 - 4 - 7 - 1 7 ( 3 0 ) 2 3 ( 3 8 ) 2 9 - 1 5 ( 1 0 - 2 0 ( 3 3 ) 3 4 ) 2 2 ( 3 7 ) 2 7 - 1 2 - 1 9 ( 3 2 ) 2 6 - 1 3 - 2 1 ( 3 5 ) 3 6 / h 1 - 3 , 5 - 6 , 1 5 - 1 7 H , 4 , 7 - 1 3 , 2 5 H 2 , ( H , 2 6 , 3 2 ) ( H , 2 7 , 3 7 ) ( H , 2 8 , 3 1 ) ( H , 2 9 , 3 8 ) ( H , 3 3 , 3 4 ) ( H , 3 5 , 3 6 ) / t 1 5 - , 1 6 - , 1 7 - / m 0 / s 1 |
| InChIKey |
N L Y X J K K W V S C T S P - U L Q D D V L X S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | HMGCR | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
