| Collection |
D4 : TTD |
| Chemical Name |
isogemichalcone C ( From PubChem : I S O G E M I C H A L C O N E C ) |
| 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 |
| 532.538 g/mol |
5 |
9 |
4.8647 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 0 H 2 8 O 9 / c 1 - 1 8 ( 1 7 - 3 9 - 2 9 ( 3 6 ) 1 4 - 5 - 1 9 - 4 - 1 1 - 2 6 ( 3 4 ) 2 8 ( 1 5 - 1 9 ) 3 8 - 2 ) 3 - 9 - 2 2 - 2 5 ( 3 3 ) 1 3 - 1 0 - 2 3 ( 3 0 ( 2 2 ) 3 7 ) 2 4 ( 3 2 ) 1 2 - 7 - 2 0 - 6 - 8 - 2 1 ( 3 1 ) 1 6 - 2 7 ( 2 0 ) 3 5 / h 3 - 8 , 1 0 - 1 6 , 3 1 , 3 3 - 3 5 , 3 7 H , 9 , 1 7 H 2 , 1 - 2 H 3 / b 1 2 - 7 + , 1 4 - 5 + , 1 8 - 3 + |
| InChIKey |
O F K H J N Z D W N K Y O Y - M N Y V G D B S S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CYP19A1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
