Gene Set: D4 : TTD - ROCAGLAMIDE
| Collection |
D4 : TTD |
| Chemical Name |
ROCAGLAMIDE ( From PubChem : R O C A G L A M I D 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 |
| 505.559 g/mol |
2 |
8 |
3.0506 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 9 H 3 1 N O 7 / c 1 - 3 0 ( 2 ) 2 7 ( 3 2 ) 2 3 - 2 4 ( 1 7 - 9 - 7 - 6 - 8 - 1 0 - 1 7 ) 2 9 ( 1 8 - 1 1 - 1 3 - 1 9 ( 3 4 - 3 ) 1 4 - 1 2 - 1 8 ) 2 8 ( 3 3 , 2 6 ( 2 3 ) 3 1 ) 2 5 - 2 1 ( 3 6 - 5 ) 1 5 - 2 0 ( 3 5 - 4 ) 1 6 - 2 2 ( 2 5 ) 3 7 - 2 9 / h 6 - 1 6 , 2 3 - 2 4 , 2 6 , 3 1 , 3 3 H , 1 - 5 H 3 / t 2 3 - , 2 4 - , 2 6 - , 2 8 + , 2 9 + / m 1 / s 1 |
| InChIKey |
D A P A Q E N N N I N U P W - I D A M A F B J S A - N
|
| Links |
|
Gene
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26)
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Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA
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