| Collection |
D4 : TTD |
| Chemical Name |
PO3 2-Nle-Trp-O-3K ( From PubChem : C H E M B L 2 2 5 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 |
| 511.634 g/mol |
3 |
8 |
1.8444 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 7 H 2 4 N 3 O 6 P . 3 K / c 1 - 2 - 3 - 7 - 1 4 ( 2 0 - 2 7 ( 2 4 , 2 5 ) 2 6 ) 1 6 ( 2 1 ) 1 9 - 1 5 ( 1 7 ( 2 2 ) 2 3 ) 9 - 1 1 - 1 0 - 1 8 - 1 3 - 8 - 5 - 4 - 6 - 1 2 ( 1 1 ) 1 3 ; ; ; / h 4 - 6 , 8 , 1 0 , 1 4 - 1 5 , 1 8 H , 2 - 3 , 7 , 9 H 2 , 1 H 3 , ( H , 1 9 , 2 1 ) ( H , 2 2 , 2 3 ) ( H 3 , 2 0 , 2 4 , 2 5 , 2 6 ) ; ; ; / q ; 3 * + 1 / p - 3 / t 1 4 - , 1 5 - ; ; ; / m 0 . . . / s 1 |
| InChIKey |
N Y V Z Q O L C R X D U O S - C E H Y L X J W S A - K
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ECE1 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
