Gene Set: D4 : TTD - ANTIOQUINE
| Collection |
D4 : TTD |
| Chemical Name |
ANTIOQUINE ( From PubChem : A N T I O Q U I 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 |
| 608.723 g/mol |
2 |
8 |
6.3155 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 7 H 4 0 N 2 O 6 / c 1 - 3 8 - 1 2 - 1 0 - 2 3 - 1 8 - 3 2 ( 4 3 - 4 ) 3 3 - 2 0 - 2 5 ( 2 3 ) 2 8 ( 3 8 ) 1 6 - 2 1 - 6 - 8 - 3 0 ( 4 0 ) 2 6 ( 1 4 - 2 1 ) 2 7 - 1 5 - 2 2 ( 7 - 9 - 3 1 ( 2 7 ) 4 2 - 3 ) 1 7 - 2 9 - 3 5 - 2 4 ( 1 1 - 1 3 - 3 9 ( 2 9 ) 2 ) 1 9 - 3 4 ( 4 4 - 5 ) 3 6 ( 4 1 ) 3 7 ( 3 5 ) 4 5 - 3 3 / h 6 - 9 , 1 4 - 1 5 , 1 8 - 2 0 , 2 8 - 2 9 , 4 0 - 4 1 H , 1 0 - 1 3 , 1 6 - 1 7 H 2 , 1 - 5 H 3 / t 2 8 - , 2 9 + / m 1 / s 1 |
| InChIKey |
M N N X I E A N P H E H S B - W D Y N H A J C S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | SLC6A3 | | | 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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