Gene Set: D1 - Approved - D A B I G A T R A N E T E X I L A T E M E S Y L A T E
| Collection |
D1 : Approved |
| Chemical Name |
D A B I G A T R A N E T E X I L A T E M E S Y L A T E |
| 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 |
| 723.839 g/mol |
3 |
15 |
6.9607 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 4 H 4 1 N 7 O 5 . C H 4 O 3 S / c 1 - 4 - 6 - 7 - 1 0 - 2 1 - 4 6 - 3 4 ( 4 4 ) 3 9 - 3 2 ( 3 5 ) 2 4 - 1 2 - 1 5 - 2 6 ( 1 6 - 1 3 - 2 4 ) 3 7 - 2 3 - 3 0 - 3 8 - 2 7 - 2 2 - 2 5 ( 1 4 - 1 7 - 2 8 ( 2 7 ) 4 0 ( 3 0 ) 3 ) 3 3 ( 4 3 ) 4 1 ( 2 0 - 1 8 - 3 1 ( 4 2 ) 4 5 - 5 - 2 ) 2 9 - 1 1 - 8 - 9 - 1 9 - 3 6 - 2 9 ; 1 - 5 ( 2 , 3 ) 4 / h 8 - 9 , 1 1 - 1 7 , 1 9 , 2 2 , 3 7 H , 4 - 7 , 1 0 , 1 8 , 2 0 - 2 1 , 2 3 H 2 , 1 - 3 H 3 , ( H 2 , 3 5 , 3 9 , 4 4 ) ; 1 H 3 , ( H , 2 , 3 , 4 ) |
| InChIKey |
X E T B X H P X H H O L O E - U H F F F A O Y S A - N
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| Links |
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Gene
(1 /
1)
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