Gene Set: D1 - Approved - I X A B E P I L O N E
| Collection |
D1 : Approved |
| Chemical Name |
I X A B E P I L O N 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 |
| 506.698 g/mol |
3 |
8 |
4.3793 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 7 H 4 2 N 2 O 5 S / c 1 - 1 5 - 9 - 8 - 1 0 - 2 7 ( 7 ) 2 2 ( 3 4 - 2 7 ) 1 2 - 2 0 ( 1 6 ( 2 ) 1 1 - 1 9 - 1 4 - 3 5 - 1 8 ( 4 ) 2 8 - 1 9 ) 2 9 - 2 3 ( 3 1 ) 1 3 - 2 1 ( 3 0 ) 2 6 ( 5 , 6 ) 2 5 ( 3 3 ) 1 7 ( 3 ) 2 4 ( 1 5 ) 3 2 / h 1 1 , 1 4 - 1 5 , 1 7 , 2 0 - 2 2 , 2 4 , 3 0 , 3 2 H , 8 - 1 0 , 1 2 - 1 3 H 2 , 1 - 7 H 3 , ( H , 2 9 , 3 1 ) / b 1 6 - 1 1 + / t 1 5 - , 1 7 + , 2 0 - , 2 1 - , 2 2 - , 2 4 - , 2 7 + / m 0 / s 1 |
| InChIKey |
F A B U F P Q F X Z V H F B - P V Y N A D R N S A - N
|
| Links |
|
Gene
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15)
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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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