| Collection |
D4 : Boss |
| Chemical Name |
uic-940t ( From PubChem : D A R U N A V I R ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Approved | Not | Not | Not | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 547.664 g/mol |
3 |
10 |
4.4282 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 7 H 3 7 N 3 O 7 S / c 1 - 1 8 ( 2 ) 1 5 - 3 0 ( 3 8 ( 3 3 , 3 4 ) 2 1 - 1 0 - 8 - 2 0 ( 2 8 ) 9 - 1 1 - 2 1 ) 1 6 - 2 4 ( 3 1 ) 2 3 ( 1 4 - 1 9 - 6 - 4 - 3 - 5 - 7 - 1 9 ) 2 9 - 2 7 ( 3 2 ) 3 7 - 2 5 - 1 7 - 3 6 - 2 6 - 2 2 ( 2 5 ) 1 2 - 1 3 - 3 5 - 2 6 / h 3 - 1 1 , 1 8 , 2 2 - 2 6 , 3 1 H , 1 2 - 1 7 , 2 8 H 2 , 1 - 2 H 3 , ( H , 2 9 , 3 2 ) / t 2 2 - , 2 3 - , 2 4 + , 2 5 - , 2 6 + / m 0 / s 1 |
| InChIKey |
C J B J H O A V Z S M M D J - H E X N F I E U S A - N
|
| Links |
|
Gene
(15 /
15)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
