| Collection |
D4 : TTD |
| Chemical Name |
SC-48928 ( From PubChem : C H E M B L 1 6 6 6 9 9 ) |
| 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 |
| 485.569 g/mol |
2 |
8 |
5.0255 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 7 H 3 5 N O 7 / c 1 - 4 - 7 - 1 8 - 2 1 ( 1 2 - 9 - 1 7 - 1 0 - 1 3 - 2 3 ( 2 7 ( 3 0 ) 3 1 ) 3 5 - 2 4 ( 1 7 ) 1 8 ) 3 3 - 1 5 - 6 - 1 6 - 3 4 - 2 2 - 1 4 - 1 1 - 2 0 ( 2 6 ( 2 8 ) 2 9 ) 2 5 ( 3 2 - 3 ) 1 9 ( 2 2 ) 8 - 5 - 2 / h 9 , 1 1 - 1 2 , 1 4 , 2 3 H , 4 - 8 , 1 0 , 1 3 , 1 5 - 1 6 H 2 , 1 - 3 H 3 , ( H 2 , 2 8 , 2 9 ) ( H , 3 0 , 3 1 ) / t 2 3 - / m 0 / s 1 |
| InChIKey |
L G H M H O H M G C T K D T - Q H C P K H F H S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | LTB4R | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
