| Collection |
D4 : TTD |
| Chemical Name |
apigenin-7-O-beta-D-glucuronide ( From PubChem : A P I G E N I N 7 - O - B - G L U C U R O N 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 |
| 446.361 g/mol |
6 |
11 |
0.1422 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 1 H 1 8 O 1 1 / c 2 2 - 9 - 3 - 1 - 8 ( 2 - 4 - 9 ) 1 3 - 7 - 1 2 ( 2 4 ) 1 5 - 1 1 ( 2 3 ) 5 - 1 0 ( 6 - 1 4 ( 1 5 ) 3 1 - 1 3 ) 3 0 - 2 1 - 1 8 ( 2 7 ) 1 6 ( 2 5 ) 1 7 ( 2 6 ) 1 9 ( 3 2 - 2 1 ) 2 0 ( 2 8 ) 2 9 / h 1 - 7 , 1 6 - 1 9 , 2 1 - 2 3 , 2 5 - 2 7 H , ( H , 2 8 , 2 9 ) / t 1 6 - , 1 7 - , 1 8 + , 1 9 - , 2 1 + / m 0 / s 1 |
| InChIKey |
J B F O L L J C G U C D Q P - Z F O R Q U D Y S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | AKR1B1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
