Gene Set: D4 : TTD - (R/R)BEFLOXATONE
| Collection |
D4 : TTD |
| Chemical Name |
(R/R)BEFLOXATONE ( From PubChem : ( R / R ) B E F L O X A T O N 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 |
| 349.302 g/mol |
1 |
6 |
2.4153 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 5 H 1 8 F 3 N O 5 / c 1 - 2 2 - 9 - 1 2 - 8 - 1 9 ( 1 4 ( 2 1 ) 2 4 - 1 2 ) 1 0 - 2 - 4 - 1 1 ( 5 - 3 - 1 0 ) 2 3 - 7 - 6 - 1 3 ( 2 0 ) 1 5 ( 1 6 , 1 7 ) 1 8 / h 2 - 5 , 1 2 - 1 3 , 2 0 H , 6 - 9 H 2 , 1 H 3 / t 1 2 - , 1 3 - / m 0 / s 1 |
| InChIKey |
I A L V D L P L C L F B C F - S T Q M W F E E S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | MAOB | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
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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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