| Collection |
D4 : CTD |
| Chemical Name |
pycnidione ( From PubChem : P Y C N I D I O N E ) |
| 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 |
| 548.667 g/mol |
3 |
7 |
4.882 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 3 H 4 0 O 7 / c 1 - 1 8 - 1 0 - 2 4 ( 3 4 ) 2 6 ( 3 6 ) 1 5 - 2 8 - 2 2 ( 1 8 ) 1 2 - 2 0 - 1 4 - 3 0 ( 3 8 ) 3 3 ( 6 ) 2 1 ( 1 7 - 3 1 ( 3 , 4 ) 8 - 7 - 9 - 3 2 ( 2 0 , 5 ) 3 9 - 2 8 ) 1 3 - 2 3 - 1 9 ( 2 ) 1 1 - 2 5 ( 3 5 ) 2 7 ( 3 7 ) 1 6 - 2 9 ( 2 3 ) 4 0 - 3 3 / h 7 - 8 , 1 0 - 1 1 , 1 5 - 1 6 , 2 0 - 2 1 , 3 0 , 3 8 H , 9 , 1 2 - 1 4 , 1 7 H 2 , 1 - 6 H 3 , ( H , 3 4 , 3 6 ) ( H , 3 5 , 3 7 ) / b 8 - 7 + / t 2 0 - , 2 1 + , 3 0 + , 3 2 - , 3 3 - / m 1 / s 1 |
| InChIKey |
B W T Q H P F S W X J O G P - B G T Y S O B Z S A - N
|
| Links |
|
Gene
(6 /
8)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
