| Collection |
D4 : TTD |
| Chemical Name |
S-ATPO ( From PubChem : C H E M B L 5 9 4 8 4 0 ) |
| 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 |
| 322.252 g/mol |
4 |
9 |
1.1408 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 1 H 1 9 N 2 O 7 P / c 1 - 1 1 ( 2 , 3 ) 8 - 6 ( 4 - 7 ( 1 2 ) 1 0 ( 1 4 ) 1 5 ) 9 ( 1 3 - 2 0 - 8 ) 1 9 - 5 - 2 1 ( 1 6 , 1 7 ) 1 8 / h 7 H , 4 - 5 , 1 2 H 2 , 1 - 3 H 3 , ( H , 1 4 , 1 5 ) ( H 2 , 1 6 , 1 7 , 1 8 ) / t 7 - / m 0 / s 1 |
| InChIKey |
A G S O O C U N M T Y P S E - Z E T C Q Y M H S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | GRIK1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
