Gene Set: D4 : TTD - desethyl isoquine
| Collection |
D4 : TTD |
| Chemical Name |
desethyl isoquine ( From PubChem : D E S E T H Y L I S 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 |
| 327.808 g/mol |
3 |
3 |
4.9108 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 8 H 1 8 C l N 3 O / c 1 - 2 - 2 0 - 1 1 - 1 2 - 3 - 5 - 1 4 ( 1 0 - 1 8 ( 1 2 ) 2 3 ) 2 2 - 1 6 - 7 - 8 - 2 1 - 1 7 - 9 - 1 3 ( 1 9 ) 4 - 6 - 1 5 ( 1 6 ) 1 7 / h 3 - 1 0 , 2 0 , 2 3 H , 2 , 1 1 H 2 , 1 H 3 , ( H , 2 1 , 2 2 ) |
| InChIKey |
X W B L H P D I C B K A E X - 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 | Inhibitor | CYP2D6 | | | 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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