| Collection |
D4 : TTD |
| Chemical Name |
N-(3,4-Difluorophenyl)propyl-ETAV ( From PubChem : C H E M B L 5 3 8 4 1 0 ) |
| 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 |
| 558.572 g/mol |
7 |
12 |
1.4896 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 5 H 3 6 F 2 N 4 O 8 / c 1 - 1 2 ( 2 ) 2 0 ( 2 5 ( 3 8 ) 3 9 ) 3 0 - 2 2 ( 3 5 ) 1 3 ( 3 ) 2 9 - 2 4 ( 3 7 ) 2 1 ( 1 4 ( 4 ) 3 2 ) 3 1 - 2 3 ( 3 6 ) 1 8 ( 7 - 8 - 1 9 ( 3 3 ) 3 4 ) 2 8 - 1 0 - 9 - 1 5 - 5 - 6 - 1 6 ( 2 6 ) 1 7 ( 2 7 ) 1 1 - 1 5 / h 5 - 6 , 1 1 - 1 4 , 1 8 , 2 0 - 2 1 , 2 8 , 3 2 H , 7 - 1 0 H 2 , 1 - 4 H 3 , ( H , 2 9 , 3 7 ) ( H , 3 0 , 3 5 ) ( H , 3 1 , 3 6 ) ( H , 3 3 , 3 4 ) ( H , 3 8 , 3 9 ) / t 1 3 - , 1 4 ? , 1 8 - , 2 0 - , 2 1 - / m 0 / s 1 |
| InChIKey |
V P S V L X P C E R T A A H - W H J B M R R R S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | DLG4 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
