| Collection |
D4 : TTD |
| Chemical Name |
AL5300 ( From PubChem : 4 - H Y D R O X Y - 1 , 1 - D I O X O - 2 - ( T H I O P H E N - 2 - Y L M E T H Y L ) - 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 |
| 380.483 g/mol |
2 |
9 |
3.4947 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 1 H 1 2 N 2 O 5 S 4 / c 1 2 - 2 1 ( 1 5 , 1 6 ) 1 0 - 4 - 8 - 9 ( 1 4 ) 6 - 1 3 ( 5 - 7 - 2 - 1 - 3 - 1 9 - 7 ) 2 2 ( 1 7 , 1 8 ) 1 1 ( 8 ) 2 0 - 1 0 / h 1 - 4 , 9 , 1 4 H , 5 - 6 H 2 , ( H 2 , 1 2 , 1 5 , 1 6 ) / t 9 - / m 0 / s 1 |
| InChIKey |
H H P U Q N G R N U O Y C D - V I F P V B Q E 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
|
