| Collection |
D4 : TTD |
| Chemical Name |
12,13-DEHYDROMANZAMINE A ( From PubChem : 1 2 , 1 3 - D E H Y D R O M A N Z A M I N E A ) |
| 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 |
| 530.745 g/mol |
1 |
3 |
7.5368 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 6 H 4 2 N 4 / c 1 - 2 - 5 - 1 1 - 2 0 - 3 9 - 2 2 - 1 8 - 3 1 - 3 0 ( 3 3 - 3 4 - 2 9 ( 1 7 - 1 9 - 3 7 - 3 3 ) 2 8 - 1 5 - 9 - 1 0 - 1 6 - 3 2 ( 2 8 ) 3 8 - 3 4 ) 2 3 - 2 6 ( 1 3 - 7 - 3 - 1 ) 3 5 - 3 6 ( 3 1 , 2 5 - 3 9 ) 2 4 - 2 7 - 1 4 - 8 - 4 - 6 - 1 2 - 2 1 - 4 0 ( 2 7 ) 3 5 / h 1 , 3 , 8 - 1 0 , 1 3 - 1 7 , 1 9 , 2 3 , 2 7 , 3 1 , 3 5 , 3 8 H , 2 , 4 - 7 , 1 1 - 1 2 , 1 8 , 2 0 - 2 2 , 2 4 - 2 5 H 2 / b 3 - 1 - , 1 4 - 8 - , 2 6 - 1 3 - / t 2 7 - , 3 1 - , 3 5 - , 3 6 - / m 0 / s 1 |
| InChIKey |
X J P Q Q K Q C G F E X K O - L L X O R J R P S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | GSK3B | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
