| Collection |
D4 : TTD |
| Chemical Name |
GNF-PF-4599 ( From PubChem : G N F - P F - 4 5 9 9 ) |
| 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 |
| 478.507 g/mol |
2 |
4 |
6.2529 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 4 H 2 9 F 3 N 4 O 3 / c 1 - 1 6 - 1 2 - 1 7 ( 2 ) 1 5 - 3 0 ( 1 4 - 1 6 ) 1 1 - 3 - 1 0 - 2 8 - 2 1 - 9 - 4 - 1 8 ( 1 3 - 2 2 ( 2 1 ) 3 1 ( 3 3 ) 3 4 ) 2 3 ( 3 2 ) 2 9 - 2 0 - 7 - 5 - 1 9 ( 6 - 8 - 2 0 ) 2 4 ( 2 5 , 2 6 ) 2 7 / h 4 - 9 , 1 3 , 1 6 - 1 7 , 2 8 H , 3 , 1 0 - 1 2 , 1 4 - 1 5 H 2 , 1 - 2 H 3 , ( H , 2 9 , 3 2 ) / t 1 6 - , 1 7 - / m 0 / s 1 |
| InChIKey |
V W D Z I C D N G X U I K B - I R X D Y D N U S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CACNA1H | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
