| Collection |
D4 : TTD |
| Chemical Name |
5-(azepan-1-ylsulfonyl)indoline-2,3-dione ( From PubChem : 1 H - A Z E P I N E , 1 - [ ( 2 , 3 - D I H Y D R O - 2 , 3 - D I O X O - 1 H - I N D O L - 5 - Y L ) S U L F O N Y L ] H E X A H Y D R O - ) |
| 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 |
| 308.353 g/mol |
1 |
6 |
2.5428 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 4 H 1 6 N 2 O 4 S / c 1 7 - 1 3 - 1 1 - 9 - 1 0 ( 5 - 6 - 1 2 ( 1 1 ) 1 5 - 1 4 ( 1 3 ) 1 8 ) 2 1 ( 1 9 , 2 0 ) 1 6 - 7 - 3 - 1 - 2 - 4 - 8 - 1 6 / h 5 - 6 , 9 H , 1 - 4 , 7 - 8 H 2 , ( H , 1 5 , 1 7 , 1 8 ) |
| InChIKey |
M L W A H V Y F M D B X B L - 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 | CASP3 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
