| Collection |
D4 : TTD |
| Chemical Name |
Exherin ( From PubChem : E X H E R I N ) |
| 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 |
| 570.685 g/mol |
7 |
15 |
0.3587 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 3 4 N 8 O 6 S 2 / c 1 - 1 0 ( 2 ) 1 7 - 2 2 ( 3 6 ) 2 9 - 1 5 ( 1 8 ( 2 3 ) 3 2 ) 7 - 3 7 - 3 8 - 8 - 1 6 ( 2 7 - 1 2 ( 4 ) 3 1 ) 2 1 ( 3 5 ) 2 8 - 1 4 ( 5 - 1 3 - 6 - 2 4 - 9 - 2 5 - 1 3 ) 2 0 ( 3 4 ) 2 6 - 1 1 ( 3 ) 1 9 ( 3 3 ) 3 0 - 1 7 / h 6 , 9 - 1 1 , 1 4 - 1 7 H , 5 , 7 - 8 H 2 , 1 - 4 H 3 , ( H 2 , 2 3 , 3 2 ) ( H , 2 4 , 2 5 ) ( H , 2 6 , 3 4 ) ( H , 2 7 , 3 1 ) ( H , 2 8 , 3 5 ) ( H , 2 9 , 3 6 ) ( H , 3 0 , 3 3 ) / t 1 1 - , 1 4 - , 1 5 - , 1 6 - , 1 7 - / m 0 / s 1 |
| InChIKey |
F Q V L R G L G W N W P S S - B X B U P L C L S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | CDH2 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
