Gene Set: D4 : CTD - Ketoconazole
| Collection |
D4 : CTD |
| Chemical Name |
Ketoconazole ( From PubChem : K E T O C O N A Z O L 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 |
| 531.431 g/mol |
0 |
8 |
4.2087 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 6 H 2 8 C l 2 N 4 O 4 / c 1 - 1 9 ( 3 3 ) 3 1 - 1 0 - 1 2 - 3 2 ( 1 3 - 1 1 - 3 1 ) 2 1 - 3 - 5 - 2 2 ( 6 - 4 - 2 1 ) 3 4 - 1 5 - 2 3 - 1 6 - 3 5 - 2 6 ( 3 6 - 2 3 , 1 7 - 3 0 - 9 - 8 - 2 9 - 1 8 - 3 0 ) 2 4 - 7 - 2 - 2 0 ( 2 7 ) 1 4 - 2 5 ( 2 4 ) 2 8 / h 2 - 9 , 1 4 , 1 8 , 2 3 H , 1 0 - 1 3 , 1 5 - 1 7 H 2 , 1 H 3 / t 2 3 - , 2 6 - / m 0 / s 1 |
| InChIKey |
X M A Y W Y J O Q H X E E K - O Z X S U G G E S A - N
|
| Links |
|
Gene
(74 /
295)
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| Download gene sets |
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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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