| Collection |
D4 : TTD |
| Chemical Name |
Cbz-Ile-MetO2-Ala-LeuVSMe ( From PubChem : C H E M B L 3 8 3 7 3 0 ) |
| 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 |
| 658.827 g/mol |
4 |
13 |
5.176 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 9 H 4 6 N 4 O 9 S 2 / c 1 - 8 - 2 0 ( 4 ) 2 5 ( 3 3 - 2 9 ( 3 7 ) 4 2 - 1 7 - 2 2 - 1 2 - 1 0 - 9 - 1 1 - 1 3 - 2 2 ) 2 8 ( 3 6 ) 3 2 - 2 4 ( 1 8 - 4 4 ( 7 , 4 0 ) 4 1 ) 2 7 ( 3 5 ) 3 0 - 2 1 ( 5 ) 2 6 ( 3 4 ) 3 1 - 2 3 ( 1 6 - 1 9 ( 2 ) 3 ) 1 4 - 1 5 - 4 3 ( 6 , 3 8 ) 3 9 / h 9 - 1 5 , 1 9 - 2 1 , 2 3 - 2 5 H , 8 , 1 6 - 1 8 H 2 , 1 - 7 H 3 , ( H , 3 0 , 3 5 ) ( H , 3 1 , 3 4 ) ( H , 3 2 , 3 6 ) ( H , 3 3 , 3 7 ) / b 1 5 - 1 4 + / t 2 0 - , 2 1 - , 2 3 + , 2 4 - , 2 5 - / m 0 / s 1 |
| InChIKey |
H I M U O M B M A B F M I W - V H I S I C E B S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CTSS | | | Discontinued target |
|
| Download gene sets |
gmt, text, Detailed text
|
