Gene Set: D4 : CTD - cisatracurium
| Collection |
D4 : CTD |
| Chemical Name |
cisatracurium ( From PubChem : C I S A T R A C U R I U M B 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 |
| 1243.48 g/mol |
0 |
18 |
11.3261 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 5 3 H 7 2 N 2 O 1 2 . 2 C 6 H 6 O 3 S / c 1 - 5 4 ( 2 2 - 1 8 - 3 8 - 3 2 - 4 8 ( 6 2 - 7 ) 5 0 ( 6 4 - 9 ) 3 4 - 4 0 ( 3 8 ) 4 2 ( 5 4 ) 2 8 - 3 6 - 1 4 - 1 6 - 4 4 ( 5 8 - 3 ) 4 6 ( 3 0 - 3 6 ) 6 0 - 5 ) 2 4 - 2 0 - 5 2 ( 5 6 ) 6 6 - 2 6 - 1 2 - 1 1 - 1 3 - 2 7 - 6 7 - 5 3 ( 5 7 ) 2 1 - 2 5 - 5 5 ( 2 ) 2 3 - 1 9 - 3 9 - 3 3 - 4 9 ( 6 3 - 8 ) 5 1 ( 6 5 - 1 0 ) 3 5 - 4 1 ( 3 9 ) 4 3 ( 5 5 ) 2 9 - 3 7 - 1 5 - 1 7 - 4 5 ( 5 9 - 4 ) 4 7 ( 3 1 - 3 7 ) 6 1 - 6 ; 2 * 7 - 1 0 ( 8 , 9 ) 6 - 4 - 2 - 1 - 3 - 5 - 6 / h 1 4 - 1 7 , 3 0 - 3 5 , 4 2 - 4 3 H , 1 1 - 1 3 , 1 8 - 2 9 H 2 , 1 - 1 0 H 3 ; 2 * 1 - 5 H , ( H , 7 , 8 , 9 ) / q + 2 ; ; / p - 2 / t 4 2 - , 4 3 - , 5 4 - , 5 5 - ; ; / m 1 . . / s 1 |
| InChIKey |
X X Z S Q O V S E B A P G S - D O N V Q R B F S A - L
|
| Links |
|
Gene
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18)
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