| Collection |
D4 : TTD |
| Chemical Name |
ATC-120 ( From PubChem : C H E M B L 4 1 2 8 8 5 ) |
| 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 |
| 419.604 g/mol |
3 |
6 |
6.0165 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 1 H 2 9 N 3 O 2 S 2 / c 1 - 1 5 ( 1 7 - 8 - 1 2 - 1 9 ( 1 3 - 9 - 1 7 ) 2 4 - 2 8 ( 5 , 2 5 ) 2 6 ) 2 3 - 2 0 ( 2 7 ) 2 2 - 1 4 - 1 6 - 6 - 1 0 - 1 8 ( 1 1 - 7 - 1 6 ) 2 1 ( 2 , 3 ) 4 / h 6 - 1 3 , 1 5 , 2 4 H , 1 4 H 2 , 1 - 5 H 3 , ( H 2 , 2 2 , 2 3 , 2 7 ) / t 1 5 - / m 1 / s 1 |
| InChIKey |
M R G D O Z G Z F F C D R J - O A H L L O K O S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | TRPV1 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
