| Collection |
D4 : TTD |
| Chemical Name |
CT-98024 ( From PubChem : 5 5 6 8 1 3 - 3 9 - 9 ) |
| 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 |
| 486.314 g/mol |
4 |
7 |
5.5003 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 0 H 1 7 C l 2 N 9 O 2 / c 2 1 - 1 1 - 1 - 2 - 1 2 ( 1 4 ( 2 2 ) 9 - 1 1 ) 1 7 - 1 3 ( 1 9 - 2 5 - 6 - 7 - 2 6 - 1 9 ) 1 0 - 2 8 - 2 0 ( 3 0 - 1 7 ) 2 7 - 8 - 5 - 2 4 - 1 6 - 4 - 3 - 1 5 ( 3 1 ( 3 2 ) 3 3 ) 1 8 ( 2 3 ) 2 9 - 1 6 / h 1 - 4 , 6 - 7 , 9 - 1 0 H , 5 , 8 H 2 , ( H , 2 5 , 2 6 ) ( H 3 , 2 3 , 2 4 , 2 9 ) ( H , 2 7 , 2 8 , 3 0 ) |
| InChIKey |
N D F X S H I I G X V O K T - U H F F F A O Y S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | GSK3B | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
