Gene Set: D4 : TTD - YM443
| Collection |
D4 : TTD |
| Chemical Name |
YM443 ( From PubChem : A C O T I 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 |
| 450.552 g/mol |
3 |
10 |
3.4307 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 1 H 3 0 N 4 O 5 S / c 1 - 1 2 ( 2 ) 2 5 ( 1 3 ( 3 ) 4 ) 8 - 7 - 2 2 - 2 0 ( 2 8 ) 1 5 - 1 1 - 3 1 - 2 1 ( 2 3 - 1 5 ) 2 4 - 1 9 ( 2 7 ) 1 4 - 9 - 1 7 ( 2 9 - 5 ) 1 8 ( 3 0 - 6 ) 1 0 - 1 6 ( 1 4 ) 2 6 / h 9 - 1 3 , 2 6 H , 7 - 8 H 2 , 1 - 6 H 3 , ( H , 2 2 , 2 8 ) ( H , 2 3 , 2 4 , 2 7 ) |
| InChIKey |
T W H Z N A U B X F Z M C A - U H F F F A O Y S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | ACHE | | | 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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