| Collection |
D4 : TTD |
| Chemical Name |
SNAP-7915 ( From PubChem : C H E M B L 9 6 4 6 7 ) |
| 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 |
| 475.503 g/mol |
1 |
6 |
5.2317 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 5 H 2 8 F 3 N 3 O 3 / c 1 - 1 6 - 2 3 ( 1 9 - 5 - 8 - 2 1 ( 2 7 ) 2 2 ( 2 8 ) 1 5 - 1 9 ) 3 1 ( 2 5 ( 3 3 ) 3 4 - 1 6 ) 2 4 ( 3 2 ) 2 9 - 1 1 - 2 - 1 2 - 3 0 - 1 3 - 9 - 1 8 ( 1 0 - 1 4 - 3 0 ) 1 7 - 3 - 6 - 2 0 ( 2 6 ) 7 - 4 - 1 7 / h 3 - 8 , 1 5 - 1 6 , 1 8 , 2 3 H , 2 , 9 - 1 4 H 2 , 1 H 3 , ( H , 2 9 , 3 2 ) / t 1 6 - , 2 3 + / m 0 / s 1 |
| InChIKey |
D T Y A F B J X W W L R M A - Q M H K H E S X S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ADRA1A | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
