Gene Set: D4 : CTD - vanoxerine
| Collection |
D4 : CTD |
| Chemical Name |
vanoxerine ( From PubChem : G B R 1 2 9 0 9 D I H Y D R O C H L O R 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 |
| 523.485 g/mol |
2 |
3 |
6.801 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 8 H 3 2 F 2 N 2 O . 2 C l H / c 2 9 - 2 6 - 1 2 - 8 - 2 4 ( 9 - 1 3 - 2 6 ) 2 8 ( 2 5 - 1 0 - 1 4 - 2 7 ( 3 0 ) 1 5 - 1 1 - 2 5 ) 3 3 - 2 2 - 2 1 - 3 2 - 1 9 - 1 7 - 3 1 ( 1 8 - 2 0 - 3 2 ) 1 6 - 4 - 7 - 2 3 - 5 - 2 - 1 - 3 - 6 - 2 3 ; ; / h 1 - 3 , 5 - 6 , 8 - 1 5 , 2 8 H , 4 , 7 , 1 6 - 2 2 H 2 ; 2 * 1 H |
| InChIKey |
M I B S K S Y C R F W I R U - U H F F F A O Y S A - N
|
| Links |
|
Gene
(16 /
34)
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University of Colorado School of Medicine
Aurora, CO 80045, USA
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