| Collection |
D4 : CTD |
| Chemical Name |
phenobarbital quinidine ( From PubChem : Q U I N I D I N E P H E N Y L E T H Y L B A R B I T U R A T 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 |
| 556.652 g/mol |
3 |
9 |
4.4691 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 0 H 2 4 N 2 O 2 . C 1 2 H 1 2 N 2 O 3 / c 1 - 3 - 1 3 - 1 2 - 2 2 - 9 - 7 - 1 4 ( 1 3 ) 1 0 - 1 9 ( 2 2 ) 2 0 ( 2 3 ) 1 6 - 6 - 8 - 2 1 - 1 8 - 5 - 4 - 1 5 ( 2 4 - 2 ) 1 1 - 1 7 ( 1 6 ) 1 8 ; 1 - 2 - 1 2 ( 8 - 6 - 4 - 3 - 5 - 7 - 8 ) 9 ( 1 5 ) 1 3 - 1 1 ( 1 7 ) 1 4 - 1 0 ( 1 2 ) 1 6 / h 3 - 6 , 8 , 1 1 , 1 3 - 1 4 , 1 9 - 2 0 , 2 3 H , 1 , 7 , 9 - 1 0 , 1 2 H 2 , 2 H 3 ; 3 - 7 H , 2 H 2 , 1 H 3 , ( H 2 , 1 3 , 1 4 , 1 5 , 1 6 , 1 7 ) / t 1 3 - , 1 4 ? , 1 9 ? , 2 0 - ; / m 0 . / s 1 |
| InChIKey |
Y H R U E R M O P B D C F D - V J F V F I R V S A - N
|
| Links |
|
Gene
(9 /
19)
⊖ Less
|
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| Download gene sets |
gmt, text, Detailed text
|
