| Collection |
D4 : TTD |
| Chemical Name |
1-adamantan-1-yl-3-(1-benzyl-piperidin-4-yl)-urea ( From PubChem : C H E M B L 3 8 7 0 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 |
| 367.528 g/mol |
2 |
4 |
4.6387 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 3 H 3 3 N 3 O / c 2 7 - 2 2 ( 2 5 - 2 3 - 1 3 - 1 8 - 1 0 - 1 9 ( 1 4 - 2 3 ) 1 2 - 2 0 ( 1 1 - 1 8 ) 1 5 - 2 3 ) 2 4 - 2 1 - 6 - 8 - 2 6 ( 9 - 7 - 2 1 ) 1 6 - 1 7 - 4 - 2 - 1 - 3 - 5 - 1 7 / h 1 - 5 , 1 8 - 2 1 H , 6 - 1 6 H 2 , ( H 2 , 2 4 , 2 5 , 2 7 ) / t 1 8 - , 1 9 + , 2 0 - , 2 3 - |
| InChIKey |
S Z C G I F N K Y J V H T L - U K B V A G S 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
|
