| Collection |
D4 : TTD |
| Chemical Name |
AL5424 ( From PubChem : 4 - H Y D R O X Y - 2 - ( 4 - M E T H O X Y P H E N Y L ) - 1 , 1 - D I O X O - 3 , 4 - D I H Y D R O T H I E N O [ 3 , 2 - E ] T H I A Z I N E - 6 - S U L F O N A M I D 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 |
| 390.455 g/mol |
2 |
9 |
3.5733 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 3 H 1 4 N 2 O 6 S 3 / c 1 - 2 1 - 9 - 4 - 2 - 8 ( 3 - 5 - 9 ) 1 5 - 7 - 1 1 ( 1 6 ) 1 0 - 6 - 1 2 ( 2 3 ( 1 4 , 1 7 ) 1 8 ) 2 2 - 1 3 ( 1 0 ) 2 4 ( 1 5 , 1 9 ) 2 0 / h 2 - 6 , 1 1 , 1 6 H , 7 H 2 , 1 H 3 , ( H 2 , 1 4 , 1 7 , 1 8 ) / t 1 1 - / m 1 / s 1 |
| InChIKey |
Z W T S O J Q G E W P W G O - L L V K D O N J S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CA2 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
