| Collection |
D4 : TTD |
| Chemical Name |
SP2456 ( From PubChem : C H E M B L 1 0 6 1 8 7 ) |
| 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 |
| 534.481 g/mol |
4 |
8 |
5.1574 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 5 H 3 3 C l 2 N 7 O 2 / c 2 6 - 1 8 - 8 - 4 - 7 - 1 7 ( 2 2 ( 1 8 ) 2 7 ) 2 0 - 1 3 - 1 9 ( 3 2 - 3 3 - 2 0 ) 1 5 - 9 - 1 1 - 3 4 ( 1 2 - 1 0 - 1 5 ) 2 1 ( 3 5 ) 1 4 - 3 0 - 2 4 ( 3 6 ) 2 3 ( 3 1 - 2 5 ( 2 8 ) 2 9 ) 1 6 - 5 - 2 - 1 - 3 - 6 - 1 6 / h 4 , 7 - 8 , 1 3 , 1 5 - 1 6 , 2 3 H , 1 - 3 , 5 - 6 , 9 - 1 2 , 1 4 H 2 , ( H , 3 0 , 3 6 ) ( H , 3 2 , 3 3 ) ( H 4 , 2 8 , 2 9 , 3 1 ) / t 2 3 - / m 1 / s 1 |
| InChIKey |
S S S X B B A S Y Y V G C I - H S Z R J F A P S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | IL2 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
