Gene Set: D4 : TTD - AS-3201
| Collection |
D4 : TTD |
| Chemical Name |
AS-3201 ( From PubChem : R A N I R E S T A T ) |
| 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 |
| 420.189 g/mol |
1 |
7 |
1.5808 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 7 H 1 1 B r F N 3 O 4 / c 1 8 - 1 0 - 4 - 3 - 9 ( 1 1 ( 1 9 ) 6 - 1 0 ) 8 - 2 1 - 1 4 ( 2 4 ) 1 2 - 2 - 1 - 5 - 2 2 ( 1 2 ) 1 7 ( 1 6 ( 2 1 ) 2 6 ) 7 - 1 3 ( 2 3 ) 2 0 - 1 5 ( 1 7 ) 2 5 / h 1 - 6 H , 7 - 8 H 2 , ( H , 2 0 , 2 3 , 2 5 ) / t 1 7 - / m 1 / s 1 |
| InChIKey |
Q C V N M N Y R N I M D K V - Q G Z V F W F L S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | AKR1B1 | | | 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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