| Collection |
D4 : TTD |
| Chemical Name |
10-hydroxy-18-methoxybetaenone ( From PubChem : C H E M B L 4 9 8 2 4 7 ) |
| 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 |
| 396.518 g/mol |
3 |
6 |
2.2461 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 3 6 O 6 / c 1 - 8 - 1 3 ( 2 ) 1 6 - 2 0 ( 5 , 1 5 ( 2 3 ) 9 - 1 0 - 2 8 - 7 ) 1 7 - 1 4 ( 3 ) 1 1 - 1 9 ( 4 , 2 5 ) 1 2 - 2 2 ( 1 7 , 2 7 ) 1 8 ( 2 4 ) 2 1 ( 1 6 , 6 ) 2 6 / h 9 - 1 0 , 1 3 - 1 4 , 1 6 - 1 7 , 2 5 - 2 7 H , 8 , 1 1 - 1 2 H 2 , 1 - 7 H 3 / b 1 0 - 9 + / t 1 3 - , 1 4 + , 1 6 + , 1 7 + , 1 9 + , 2 0 + , 2 1 - , 2 2 + / m 0 / s 1 |
| InChIKey |
O N Z D N B G T A V E Q Q N - G S U H U V J F S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CDK4 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
