| Collection |
D4 : TTD |
| Chemical Name |
LCZ696 ( From PubChem : L C Z 6 9 6 ) |
| 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 |
| 970.025 g/mol |
7 |
16 |
8.1947 |
False(0/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 4 H 2 9 N 5 O 3 . C 2 4 H 2 9 N O 5 . 3 N a . 3 H 2 O / c 1 - 4 - 5 - 1 0 - 2 1 ( 3 0 ) 2 9 ( 2 2 ( 1 6 ( 2 ) 3 ) 2 4 ( 3 1 ) 3 2 ) 1 5 - 1 7 - 1 1 - 1 3 - 1 8 ( 1 4 - 1 2 - 1 7 ) 1 9 - 8 - 6 - 7 - 9 - 2 0 ( 1 9 ) 2 3 - 2 5 - 2 7 - 2 8 - 2 6 - 2 3 ; 1 - 3 - 3 0 - 2 4 ( 2 9 ) 1 7 ( 2 ) 1 5 - 2 1 ( 2 5 - 2 2 ( 2 6 ) 1 3 - 1 4 - 2 3 ( 2 7 ) 2 8 ) 1 6 - 1 8 - 9 - 1 1 - 2 0 ( 1 2 - 1 0 - 1 8 ) 1 9 - 7 - 5 - 4 - 6 - 8 - 1 9 ; ; ; ; ; ; / h 6 - 9 , 1 1 - 1 4 , 1 6 , 2 2 H , 4 - 5 , 1 0 , 1 5 H 2 , 1 - 3 H 3 , ( H , 3 1 , 3 2 ) ( H , 2 5 , 2 6 , 2 7 , 2 8 ) ; 4 - 1 2 , 1 7 , 2 1 H , 3 , 1 3 - 1 6 H 2 , 1 - 2 H 3 , ( H , 2 5 , 2 6 ) ( H , 2 7 , 2 8 ) ; ; ; ; 3 * 1 H 2 / q ; ; 3 * + 1 ; ; ; / t 2 2 - ; 1 7 - , 2 1 + ; ; ; ; ; ; / m 0 1 . . . . . . / s 1 |
| InChIKey |
A C X L N S L R L Q L E A L - H W S D W T S L S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | MME | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
