| Collection |
D4 : TTD |
| Chemical Name |
2-chloro-2'-C-methyl-tecadenoson ( From PubChem : C H E M B L 4 0 0 7 8 2 ) |
| 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 |
| 385.803 g/mol |
4 |
10 |
-0.2449 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 5 H 2 0 C l N 5 O 5 / c 1 - 1 5 ( 2 4 ) 1 0 ( 2 3 ) 8 ( 4 - 2 2 ) 2 6 - 1 3 ( 1 5 ) 2 1 - 6 - 1 7 - 9 - 1 1 ( 1 8 - 7 - 2 - 3 - 2 5 - 5 - 7 ) 1 9 - 1 4 ( 1 6 ) 2 0 - 1 2 ( 9 ) 2 1 / h 6 - 8 , 1 0 , 1 3 , 2 2 - 2 4 H , 2 - 5 H 2 , 1 H 3 , ( H , 1 8 , 1 9 , 2 0 ) / t 7 - , 8 - , 1 0 - , 1 3 - , 1 5 - / m 1 / s 1 |
| InChIKey |
P K A K D O U F C O Q H O J - R A P C H X A I S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ADORA2B | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
