| Collection |
D4 : TTD |
| Chemical Name |
AP22408 ( From PubChem : U N I I - 3 U 3 L 5 Q R 4 K V ) |
| 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 |
| 665.608 g/mol |
7 |
13 |
3.4638 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 0 H 4 1 N 3 O 1 0 P 2 / c 1 - 1 8 ( 3 4 ) 3 2 - 2 5 ( 1 3 - 2 0 - 1 1 - 1 2 - 2 7 ( 4 4 ( 3 7 , 3 8 ) 3 9 ) 2 8 ( 1 4 - 2 0 ) 4 5 ( 4 0 , 4 1 ) 4 2 ) 3 0 ( 3 6 ) 3 3 - 2 4 - 1 0 - 6 - 5 - 9 - 2 1 - 1 5 - 2 6 ( 2 3 ( 2 9 ( 3 1 ) 3 5 ) 1 6 - 2 2 ( 2 1 ) 2 4 ) 4 3 - 1 7 - 1 9 - 7 - 3 - 2 - 4 - 8 - 1 9 / h 1 1 - 1 2 , 1 4 - 1 6 , 1 9 , 2 4 - 2 5 H , 2 - 1 0 , 1 3 , 1 7 H 2 , 1 H 3 , ( H 2 , 3 1 , 3 5 ) ( H , 3 2 , 3 4 ) ( H , 3 3 , 3 6 ) ( H 2 , 3 7 , 3 8 , 3 9 ) ( H 2 , 4 0 , 4 1 , 4 2 ) / t 2 4 - , 2 5 - / m 0 / s 1 |
| InChIKey |
S P S G Y T W O I G A A B K - D Q E Y M E C F S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | SRC | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
