| Collection |
D4 : TTD |
| Chemical Name |
Ac-Asp-Glu-Val-Asp-CHO ( From PubChem : C P P 3 2 / A P O P A I N I N H I B I T O R ) |
| 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 |
| 502.472 g/mol |
7 |
15 |
-0.8218 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 0 H 3 0 N 4 O 1 1 / c 1 - 9 ( 2 ) 1 7 ( 2 0 ( 3 5 ) 2 2 - 1 1 ( 8 - 2 5 ) 6 - 1 5 ( 2 9 ) 3 0 ) 2 4 - 1 8 ( 3 3 ) 1 2 ( 4 - 5 - 1 4 ( 2 7 ) 2 8 ) 2 3 - 1 9 ( 3 4 ) 1 3 ( 7 - 1 6 ( 3 1 ) 3 2 ) 2 1 - 1 0 ( 3 ) 2 6 / h 8 - 9 , 1 1 - 1 3 , 1 7 H , 4 - 7 H 2 , 1 - 3 H 3 , ( H , 2 1 , 2 6 ) ( H , 2 2 , 3 5 ) ( H , 2 3 , 3 4 ) ( H , 2 4 , 3 3 ) ( H , 2 7 , 2 8 ) ( H , 2 9 , 3 0 ) ( H , 3 1 , 3 2 ) |
| InChIKey |
U M B V A P C O N C I L T 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
|
