| Collection |
D4 : TTD |
| Chemical Name |
1-adamantan-1-yl-3-(2-hydroxyethyl)urea ( From PubChem : 1 - A D A M A N T A N - 1 - Y L - 3 - ( 2 - H Y D R O X Y E T H Y L ) U R E A ) |
| 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 |
| 238.326 g/mol |
3 |
4 |
2.0285 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 3 H 2 2 N 2 O 2 / c 1 6 - 2 - 1 - 1 4 - 1 2 ( 1 7 ) 1 5 - 1 3 - 6 - 9 - 3 - 1 0 ( 7 - 1 3 ) 5 - 1 1 ( 4 - 9 ) 8 - 1 3 / h 9 - 1 1 , 1 6 H , 1 - 8 H 2 , ( H 2 , 1 4 , 1 5 , 1 7 ) / t 9 - , 1 0 + , 1 1 - , 1 3 - |
| InChIKey |
B B H Y F N M M U B V B E X - D N S L J T B W 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
|
