| Collection |
D4 : TTD |
| Chemical Name |
10-CF3C(OH)2-DDACTHF ( From PubChem : 1 0 - C F 3 C ( O H ) 2 - D D A C T H F ) |
| 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 |
| 549.497 g/mol |
9 |
13 |
1.5433 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 3 0 F 3 N 5 O 8 / c 2 3 - 2 2 ( 2 4 , 2 5 ) 2 1 ( 3 7 , 3 8 ) 1 3 ( 3 - 1 - 2 - 1 2 - 1 6 ( 2 6 ) 2 9 - 2 0 ( 2 7 ) 3 0 - 1 8 ( 1 2 ) 3 4 ) 1 0 - 4 - 6 - 1 1 ( 7 - 5 - 1 0 ) 1 7 ( 3 3 ) 2 8 - 1 4 ( 1 9 ( 3 5 ) 3 6 ) 8 - 9 - 1 5 ( 3 1 ) 3 2 / h 4 - 7 , 1 2 - 1 4 , 1 6 , 2 0 , 2 9 , 3 7 - 3 8 H , 1 - 3 , 8 - 9 , 2 6 - 2 7 H 2 , ( H , 2 8 , 3 3 ) ( H , 3 0 , 3 4 ) ( H , 3 1 , 3 2 ) ( H , 3 5 , 3 6 ) / t 1 2 - , 1 3 + , 1 4 - , 1 6 + , 2 0 - / m 1 / s 1 |
| InChIKey |
K O L D L U F B E M U Z I M - W U A Y E B G V S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | GART | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
