| Collection |
D4 : CTD |
| Chemical Name |
brusatol ( From PubChem : B R U S A T O L ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Not | Not | Not | Not | Not | Not | Approved | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 520.526 g/mol |
3 |
11 |
0.517 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 6 H 3 2 O 1 1 / c 1 - 1 0 ( 2 ) 6 - 1 5 ( 2 8 ) 3 7 - 1 8 - 2 0 - 2 5 - 9 - 3 5 - 2 6 ( 2 0 , 2 3 ( 3 3 ) 3 4 - 5 ) 2 1 ( 3 1 ) 1 7 ( 3 0 ) 1 9 ( 2 5 ) 2 4 ( 4 ) 8 - 1 3 ( 2 7 ) 1 6 ( 2 9 ) 1 1 ( 3 ) 1 2 ( 2 4 ) 7 - 1 4 ( 2 5 ) 3 6 - 2 2 ( 1 8 ) 3 2 / h 6 , 1 2 , 1 4 , 1 7 - 2 1 , 2 9 - 3 1 H , 7 - 9 H 2 , 1 - 5 H 3 / t 1 2 - , 1 4 + , 1 7 + , 1 8 + , 1 9 + , 2 0 + , 2 1 - , 2 4 - , 2 5 + , 2 6 - / m 0 / s 1 |
| InChIKey |
Z Z Z Y H I M V K O H V I H - V I L O D J C F S A - N
|
| Links |
|
Gene
(2 /
7)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
