| Collection |
D4 : Boss |
| Chemical Name |
alpha-idosane ( From PubChem : H E P A R I T I N ) |
| 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 |
| 637.522 g/mol |
5 |
22 |
-2.274 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 4 H 2 4 N O 2 1 S 3 / c 1 - 2 9 - 9 - 7 ( 1 7 ) 1 0 ( 3 5 - 3 8 ( 2 3 , 2 4 ) 2 5 ) 1 4 ( 3 4 - 1 1 ( 9 ) 1 2 ( 1 8 ) 1 9 ) 3 3 - 8 - 4 ( 3 - 3 1 - 3 7 ( 2 0 , 2 1 ) 2 2 ) 3 2 - 1 3 ( 3 0 - 2 ) 5 ( 6 ( 8 ) 1 6 ) 1 5 - 3 6 - 3 9 ( 2 6 , 2 7 ) 2 8 / h 4 - 1 1 , 1 3 - 1 5 , 1 7 H , 3 H 2 , 1 - 2 H 3 , ( H , 1 8 , 1 9 ) ( H , 2 0 , 2 1 , 2 2 ) ( H , 2 3 , 2 4 , 2 5 ) ( H , 2 6 , 2 7 , 2 8 ) / q - 1 / p - 1 / t 4 - , 5 - , 6 - , 7 + , 8 - , 9 + , 1 0 - , 1 1 - , 1 3 + , 1 4 + / m 0 / s 1 |
| InChIKey |
W K P U A C L Q L I I V J J - R H K L H V F K S A - M
|
| Links |
|
Gene
(90 /
90)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
