| Collection |
D3 |
| Chemical Name |
P R E S T W I C K - 6 8 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 |
| 600.831 g/mol |
0 |
4 |
6.1739 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 8 H 5 2 N 2 O 4 / c 1 - 5 - 3 9 ( 3 ) 2 7 - 1 6 - 1 7 - 2 8 ( 3 9 ) 2 3 - 3 1 ( 2 2 - 2 7 ) 4 3 - 3 6 ( 4 1 ) 3 4 - 2 0 - 2 1 - 3 8 ( 2 6 - 1 2 - 8 - 7 - 9 - 1 3 - 2 6 , 3 5 - 1 5 - 1 1 - 1 0 - 1 4 - 3 3 ( 3 4 ) 3 5 ) 3 7 ( 4 2 ) 4 4 - 3 2 - 2 4 - 2 9 - 1 8 - 1 9 - 3 0 ( 2 5 - 3 2 ) 4 0 ( 2 9 , 4 ) 6 - 2 / h 7 - 1 5 , 2 7 - 3 2 , 3 4 H , 5 - 6 , 1 6 - 2 5 H 2 , 1 - 4 H 3 / q + 2 / t 2 7 ? , 2 8 ? , 2 9 ? , 3 0 ? , 3 1 ? , 3 2 ? , 3 4 - , 3 8 ? , 3 9 ? , 4 0 ? / m 0 / s 1 |
| InChIKey |
L I I I L P I X O Y W U H W - B M A H A P D U S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Concentration(M) | Regulation | Cell Line | Gene | | 0.000006 | UP | PC3 | OAS1 |
|
| Download gene sets |
Cell Line PC3 : gmt, text, Detailed text
|
