| Collection |
D4 : TTD |
| Chemical Name |
1,1,1,2,2,4-hexafluoro-7-phenylheptan-3-one ( From PubChem : 1 , 1 , 1 , 2 , 2 , 4 - H E X A F L U O R O - 7 - P H E N Y L H E P T A N - 3 - O N E ) |
| 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 |
| 298.224 g/mol |
0 |
1 |
4.1141 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 3 H 1 2 F 6 O / c 1 4 - 1 0 ( 1 1 ( 2 0 ) 1 2 ( 1 5 , 1 6 ) 1 3 ( 1 7 , 1 8 ) 1 9 ) 8 - 4 - 7 - 9 - 5 - 2 - 1 - 3 - 6 - 9 / h 1 - 3 , 5 - 6 , 1 0 H , 4 , 7 - 8 H 2 / t 1 0 - / m 0 / s 1 |
| InChIKey |
N O Y V S S P M D R U W C C - J T Q L Q I E I S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | PLA2G4A | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
