| Collection |
D4 : TTD |
| Chemical Name |
GLPTGG ( From PubChem : C H E M B L 2 6 1 3 3 4 ) |
| 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 |
| 500.546 g/mol |
7 |
14 |
-1.1486 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 1 H 3 6 N 6 O 8 / c 1 - 1 1 ( 2 ) 7 - 1 3 ( 2 5 - 1 5 ( 2 9 ) 8 - 2 2 ) 2 1 ( 3 5 ) 2 7 - 6 - 4 - 5 - 1 4 ( 2 7 ) 1 9 ( 3 3 ) 2 6 - 1 8 ( 1 2 ( 3 ) 2 8 ) 2 0 ( 3 4 ) 2 4 - 9 - 1 6 ( 3 0 ) 2 3 - 1 0 - 1 7 ( 3 1 ) 3 2 / h 1 1 - 1 4 , 1 8 , 2 8 H , 4 - 1 0 , 2 2 H 2 , 1 - 3 H 3 , ( H , 2 3 , 3 0 ) ( H , 2 4 , 3 4 ) ( H , 2 5 , 2 9 ) ( H , 2 6 , 3 3 ) ( H , 3 1 , 3 2 ) / t 1 2 - , 1 3 + , 1 4 + , 1 8 + / m 1 / s 1 |
| InChIKey |
F Y P R I K V H H V Q E T D - C O J S N B R M 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
|
