Gene Set: D4 : CTD - rocuronium
| Collection |
D4 : CTD |
| Chemical Name |
rocuronium ( From PubChem : R O C U R O N I U M ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Approved | Not | Not | Approved | Approved | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 529.774 g/mol |
1 |
5 |
4.3042 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 2 H 5 3 N 2 O 4 / c 1 - 5 - 1 4 - 3 4 ( 1 5 - 6 - 7 - 1 6 - 3 4 ) 2 8 - 2 0 - 2 6 - 2 4 - 9 - 8 - 2 3 - 1 9 - 2 9 ( 3 6 ) 2 7 ( 3 3 - 1 2 - 1 7 - 3 7 - 1 8 - 1 3 - 3 3 ) 2 1 - 3 2 ( 2 3 , 4 ) 2 5 ( 2 4 ) 1 0 - 1 1 - 3 1 ( 2 6 , 3 ) 3 0 ( 2 8 ) 3 8 - 2 2 ( 2 ) 3 5 / h 5 , 2 3 - 3 0 , 3 6 H , 1 , 6 - 2 1 H 2 , 2 - 4 H 3 / q + 1 / t 2 3 - , 2 4 + , 2 5 - , 2 6 - , 2 7 - , 2 8 - , 2 9 - , 3 0 - , 3 1 - , 3 2 - / m 0 / s 1 |
| InChIKey |
Y X R D K M P I G H S V R X - O O J C L D B C S A - N
|
| Links |
|
Gene
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24)
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12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA
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