| Collection |
D4 : TTD |
| Chemical Name |
N6-Benzyl Adenosine-5'-Diphosphate ( From PubChem : N 6 - B E N Z Y L A D E N O S I N E - 5 ' - D I P H O S P H A T E ) |
| 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 |
| 517.324 g/mol |
6 |
15 |
0.3569 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 7 H 2 1 N 5 O 1 0 P 2 / c 2 3 - 1 3 - 1 1 ( 7 - 3 0 - 3 4 ( 2 8 , 2 9 ) 3 2 - 3 3 ( 2 5 , 2 6 ) 2 7 ) 3 1 - 1 7 ( 1 4 ( 1 3 ) 2 4 ) 2 2 - 9 - 2 1 - 1 2 - 1 5 ( 1 9 - 8 - 2 0 - 1 6 ( 1 2 ) 2 2 ) 1 8 - 6 - 1 0 - 4 - 2 - 1 - 3 - 5 - 1 0 / h 1 - 5 , 8 - 9 , 1 1 , 1 3 - 1 4 , 1 7 , 2 3 - 2 4 H , 6 - 7 H 2 , ( H , 2 8 , 2 9 ) ( H , 1 8 , 1 9 , 2 0 ) ( H 2 , 2 5 , 2 6 , 2 7 ) / t 1 1 - , 1 3 - , 1 4 - , 1 7 - / m 1 / s 1 |
| InChIKey |
M R H G M A G S D A Q U F H - L S C F U A H R 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
|
