| Collection |
D4 : TTD |
| Chemical Name |
E6201 ( From PubChem : U N I I - C Z P 9 G B 2 5 H O ) |
| 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 |
| 389.442 g/mol |
4 |
7 |
2.3424 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 1 H 2 7 N O 6 / c 1 - 4 - 2 2 - 1 5 - 1 0 - 1 4 - 6 - 5 - 7 - 1 6 ( 2 3 ) 2 0 ( 2 6 ) 1 7 ( 2 4 ) 9 - 8 - 1 2 ( 2 ) 1 3 ( 3 ) 2 8 - 2 1 ( 2 7 ) 1 9 ( 1 4 ) 1 8 ( 2 5 ) 1 1 - 1 5 / h 5 - 6 , 8 - 1 3 , 1 6 , 2 0 , 2 2 - 2 3 , 2 5 - 2 6 H , 4 , 7 H 2 , 1 - 3 H 3 / b 6 - 5 + , 9 - 8 - / t 1 2 - , 1 3 + , 1 6 + , 2 0 + / m 1 / s 1 |
| InChIKey |
M W U F V Y L A W A X D H Q - H M N L T A H H S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | MAP3K1 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
