Gene Set: D4 : CTD - Emetine
| Collection |
D4 : CTD |
| Chemical Name |
Emetine ( From PubChem : E M E T I N E ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Not | Not | Not | Not | Not | Not | Approved | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 480.639 g/mol |
1 |
6 |
5.2101 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 9 H 4 0 N 2 O 4 / c 1 - 6 - 1 8 - 1 7 - 3 1 - 1 0 - 8 - 2 0 - 1 4 - 2 7 ( 3 3 - 3 ) 2 9 ( 3 5 - 5 ) 1 6 - 2 3 ( 2 0 ) 2 5 ( 3 1 ) 1 2 - 2 1 ( 1 8 ) 1 1 - 2 4 - 2 2 - 1 5 - 2 8 ( 3 4 - 4 ) 2 6 ( 3 2 - 2 ) 1 3 - 1 9 ( 2 2 ) 7 - 9 - 3 0 - 2 4 / h 1 3 - 1 6 , 1 8 , 2 1 , 2 4 - 2 5 , 3 0 H , 6 - 1 2 , 1 7 H 2 , 1 - 5 H 3 / t 1 8 - , 2 1 - , 2 4 + , 2 5 - / m 0 / s 1 |
| InChIKey |
A U V V A X Y I E L K V A I - C K B K H P S W S A - N
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| Links |
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Gene
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39)
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