| Collection |
D4 : TTD |
| Chemical Name |
NE-10575 ( From PubChem : N E - 1 0 5 7 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 |
| 298.147 g/mol |
5 |
7 |
-0.9449 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 8 H 1 3 N O 7 P 2 / c 1 - 9 - 4 - 2 - 3 - 7 ( 6 - 9 ) 5 - 8 ( 1 0 , 1 7 ( 1 1 , 1 2 ) 1 3 ) 1 8 ( 1 4 , 1 5 ) 1 6 / h 2 - 4 , 6 , 1 0 H , 5 H 2 , 1 H 3 , ( H 3 - , 1 1 , 1 2 , 1 3 , 1 4 , 1 5 , 1 6 ) / p + 1 |
| InChIKey |
B B N R L G Q P S I X F H Z - U H F F F A O Y S A - O
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | FDPS | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
