| Collection |
D4 : TTD |
| Chemical Name |
1-(3-Chloro-phenyl)-3-(4-hydroxy-decyl)-urea ( From PubChem : C H E M B L 6 6 4 9 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 |
| 326.861 g/mol |
3 |
4 |
5.0369 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 7 H 2 7 C l N 2 O 2 / c 1 - 2 - 3 - 4 - 5 - 1 0 - 1 6 ( 2 1 ) 1 1 - 7 - 1 2 - 1 9 - 1 7 ( 2 2 ) 2 0 - 1 5 - 9 - 6 - 8 - 1 4 ( 1 8 ) 1 3 - 1 5 / h 6 , 8 - 9 , 1 3 , 1 6 , 2 1 H , 2 - 5 , 7 , 1 0 - 1 2 H 2 , 1 H 3 , ( H 2 , 1 9 , 2 0 , 2 2 ) / t 1 6 - / m 1 / s 1 |
| InChIKey |
Z D F K G B J P F G F B Q J - M R X N P F E D 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
|
