| Collection |
D4 : TTD |
| Chemical Name |
(+/-)-5'-deoxy-4'-fluoro-5'-methylthio-DADMe-ImmH ( From PubChem : D N C 0 0 9 6 1 2 ) |
| 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 |
| 312.363 g/mol |
3 |
5 |
0.4369 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 3 H 1 7 F N 4 O 2 S / c 1 - 2 1 - 6 - 1 3 ( 1 4 ) 5 - 1 8 ( 4 - 9 ( 1 3 ) 1 9 ) 3 - 8 - 2 - 1 5 - 1 1 - 1 0 ( 8 ) 1 6 - 7 - 1 7 - 1 2 ( 1 1 ) 2 0 / h 2 , 7 , 9 , 1 5 , 1 9 H , 3 - 6 H 2 , 1 H 3 , ( H , 1 6 , 1 7 , 2 0 ) / t 9 - , 1 3 - / m 0 / s 1 |
| InChIKey |
K A D O M G H M E U L J S O - Z A N V P E C I S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | PNP | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
