| Collection |
D4 : TTD |
| Chemical Name |
PF-3052334 ( From PubChem : P F - 3 0 5 2 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 |
| 533.567 g/mol |
3 |
8 |
2.9486 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 8 H 3 4 F N 3 O 5 . N a / c 1 - 1 7 ( 2 ) 2 6 - 2 4 ( 1 3 - 1 2 - 2 2 ( 3 3 ) 1 4 - 2 3 ( 3 4 ) 1 5 - 2 5 ( 3 5 ) 3 6 ) 3 2 ( 2 1 - 1 0 - 8 - 2 0 ( 2 9 ) 9 - 1 1 - 2 1 ) 3 1 - 2 7 ( 2 6 ) 2 8 ( 3 7 ) 3 0 - 1 6 - 1 9 - 6 - 4 - 1 8 ( 3 ) 5 - 7 - 1 9 ; / h 4 - 1 1 , 1 7 , 2 2 - 2 3 , 3 3 - 3 4 H , 1 2 - 1 6 H 2 , 1 - 3 H 3 , ( H , 3 0 , 3 7 ) ( H , 3 5 , 3 6 ) ; / q ; + 1 / p - 1 / t 2 2 - , 2 3 - ; / m 1 . / s 1 |
| InChIKey |
V E G K D A A I L H T M L D - O H I D F Y L O S A - M
|
| 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
|
