| Collection |
D4 : TTD |
| Chemical Name |
1-adamantan-1-yl-3-(1-ethyl-piperidin-4-yl)-urea ( From PubChem : C H E M B L 2 1 4 5 3 4 ) |
| 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 |
| 305.458 g/mol |
2 |
4 |
3.4584 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 8 H 3 1 N 3 O / c 1 - 2 - 2 1 - 5 - 3 - 1 6 ( 4 - 6 - 2 1 ) 1 9 - 1 7 ( 2 2 ) 2 0 - 1 8 - 1 0 - 1 3 - 7 - 1 4 ( 1 1 - 1 8 ) 9 - 1 5 ( 8 - 1 3 ) 1 2 - 1 8 / h 1 3 - 1 6 H , 2 - 1 2 H 2 , 1 H 3 , ( H 2 , 1 9 , 2 0 , 2 2 ) / t 1 3 - , 1 4 + , 1 5 - , 1 8 - |
| InChIKey |
S M B X A X B A A I G I A K - O V M O H I I O S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | EPHX2 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
