| Collection |
D4 : TTD |
| Chemical Name |
YM533 ( From PubChem : B E R A P R O S T S O D I U M ) |
| 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 |
| 420.474 g/mol |
2 |
5 |
1.9512 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 4 H 3 0 O 5 . N a / c 1 - 3 - 4 - 7 - 1 5 ( 2 ) 1 9 ( 2 5 ) 1 3 - 1 2 - 1 7 - 2 0 ( 2 6 ) 1 4 - 2 1 - 2 3 ( 1 7 ) 1 8 - 1 0 - 5 - 8 - 1 6 ( 2 4 ( 1 8 ) 2 9 - 2 1 ) 9 - 6 - 1 1 - 2 2 ( 2 7 ) 2 8 ; / h 5 , 8 , 1 0 , 1 2 - 1 3 , 1 5 , 1 7 , 1 9 - 2 1 , 2 3 , 2 5 - 2 6 H , 6 - 7 , 9 , 1 1 , 1 4 H 2 , 1 - 2 H 3 , ( H , 2 7 , 2 8 ) ; / q ; + 1 / p - 1 / b 1 3 - 1 2 + ; |
| InChIKey |
Y T C Z Z X I R L A R S E T - U E I G I M K U S A - M
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | PTGIR | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
