| Collection |
D4 : TTD |
| Chemical Name |
Ac-Ala-Pro-Val-(2-benzoxazole) ( From PubChem : C H E M B L 4 3 8 7 0 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 |
| 428.482 g/mol |
2 |
9 |
2.3866 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 2 8 N 4 O 5 / c 1 - 1 2 ( 2 ) 1 8 ( 1 9 ( 2 8 ) 2 1 - 2 4 - 1 5 - 8 - 5 - 6 - 1 0 - 1 7 ( 1 5 ) 3 1 - 2 1 ) 2 5 - 2 0 ( 2 9 ) 1 6 - 9 - 7 - 1 1 - 2 6 ( 1 6 ) 2 2 ( 3 0 ) 1 3 ( 3 ) 2 3 - 1 4 ( 4 ) 2 7 / h 5 - 6 , 8 , 1 0 , 1 2 - 1 3 , 1 6 , 1 8 H , 7 , 9 , 1 1 H 2 , 1 - 4 H 3 , ( H , 2 3 , 2 7 ) ( H , 2 5 , 2 9 ) / t 1 3 - , 1 6 - , 1 8 - / m 0 / s 1 |
| InChIKey |
B I T O R O A C N L S R M E - O W Q G Q X M Q S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ELANE | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
