Gene Set: D4 : TTD - SM 11044
| Collection |
D4 : TTD |
| Chemical Name |
SM 11044 ( From PubChem : S M 1 1 0 4 4 ) |
| 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 |
| 483.371 g/mol |
5 |
6 |
3.7706 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 2 7 F N 2 O 4 . B r H / c 2 3 - 1 7 - 8 - 5 - 1 5 ( 6 - 9 - 1 7 ) 4 - 3 - 1 1 - 2 4 - 2 0 ( 2 2 ( 2 9 ) 2 5 - 1 2 - 1 - 2 - 1 3 - 2 5 ) 2 1 ( 2 8 ) 1 6 - 7 - 1 0 - 1 8 ( 2 6 ) 1 9 ( 2 7 ) 1 4 - 1 6 ; / h 5 - 1 0 , 1 4 , 2 0 - 2 1 , 2 4 , 2 6 - 2 8 H , 1 - 4 , 1 1 - 1 3 H 2 ; 1 H / t 2 0 - , 2 1 + ; / m 0 . / s 1 |
| InChIKey |
V G H B G P U S J I T F J L - J U D Y Q F G C S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Agonist | ADRB3 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
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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