| Collection |
D4 : TTD |
| Chemical Name |
MF268 ( From PubChem : M F 2 6 8 ) |
| 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 |
| 486.69 g/mol |
1 |
7 |
4.9256 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 8 H 4 6 N 4 O 3 / c 1 - 2 1 - 1 9 - 3 2 ( 2 0 - 2 2 ( 2 ) 3 4 - 2 1 ) 1 6 - 1 1 - 9 - 7 - 6 - 8 - 1 0 - 1 5 - 2 9 - 2 7 ( 3 3 ) 3 5 - 2 3 - 1 2 - 1 3 - 2 5 - 2 4 ( 1 8 - 2 3 ) 2 8 ( 3 ) 1 4 - 1 7 - 3 0 ( 4 ) 2 6 ( 2 8 ) 3 1 ( 2 5 ) 5 / h 1 2 - 1 3 , 1 8 , 2 1 - 2 2 , 2 6 H , 6 - 1 1 , 1 4 - 1 7 , 1 9 - 2 0 H 2 , 1 - 5 H 3 , ( H , 2 9 , 3 3 ) / t 2 1 - , 2 2 + , 2 6 - , 2 8 + / m 1 / s 1 |
| InChIKey |
C J M J X T W M G X R F O M - F K T U R H E W S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ACHE | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
