Gene Set: D4 : CTD - celecoxib
| Collection |
D4 : CTD |
| Chemical Name |
celecoxib ( From PubChem : C E L E C O X I B ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Approved | Not | Not | Approved | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 381.372 g/mol |
1 |
5 |
5.295 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 7 H 1 4 F 3 N 3 O 2 S / c 1 - 1 1 - 2 - 4 - 1 2 ( 5 - 3 - 1 1 ) 1 5 - 1 0 - 1 6 ( 1 7 ( 1 8 , 1 9 ) 2 0 ) 2 2 - 2 3 ( 1 5 ) 1 3 - 6 - 8 - 1 4 ( 9 - 7 - 1 3 ) 2 6 ( 2 1 , 2 4 ) 2 5 / h 2 - 1 0 H , 1 H 3 , ( H 2 , 2 1 , 2 4 , 2 5 ) |
| InChIKey |
R Z E K V G V H F L E Q I L - U H F F F A O Y S A - N
|
| Links |
|
Gene
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440)
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Contact us
Tan Lab , Mail Stop 8117
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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