| Collection |
D4 : TTD |
| Chemical Name |
Isoxazol ( From PubChem : I S O X A Z O L ) |
| 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 |
| 355.514 g/mol |
1 |
3 |
5.0382 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 3 H 3 3 N O 2 / c 1 - 2 0 ( 2 ) 1 8 - 7 - 6 - 1 5 - 1 6 ( 2 1 ( 1 8 , 3 ) 1 2 - 1 4 - 1 3 - 2 4 - 2 6 - 1 9 ( 1 4 ) 2 0 ) 8 - 1 0 - 2 2 ( 4 ) 1 7 ( 1 5 ) 9 - 1 1 - 2 3 ( 2 2 , 5 ) 2 5 / h 7 , 1 3 , 1 5 - 1 7 , 2 5 H , 6 , 8 - 1 2 H 2 , 1 - 5 H 3 / t 1 5 - , 1 6 + , 1 7 + , 2 1 - , 2 2 + , 2 3 + / m 1 / s 1 |
| InChIKey |
A X L O C H L T N Q D F F S - B E S J Y Z O M S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | DHODH | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
