| Collection |
D4 : TTD |
| Chemical Name |
SB 272844 ( From PubChem : F C E - 2 4 5 1 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 |
| 734.076 g/mol |
7 |
14 |
6.0108 |
False(0/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 2 H 3 8 C l 2 N 1 0 O 4 . C l H / c 1 - 4 1 - 1 8 - 2 2 ( 1 4 - 2 5 ( 4 1 ) 3 0 ( 4 6 ) 3 7 - 1 1 - 8 - 2 8 ( 3 5 ) 3 6 ) 3 9 - 3 2 ( 4 8 ) 2 7 - 1 6 - 2 3 ( 1 9 - 4 3 ( 2 7 ) 3 ) 4 0 - 3 1 ( 4 7 ) 2 6 - 1 5 - 2 1 ( 1 7 - 4 2 ( 2 6 ) 2 ) 3 8 - 2 9 ( 4 5 ) 2 0 - 4 - 6 - 2 4 ( 7 - 5 - 2 0 ) 4 4 ( 1 2 - 9 - 3 3 ) 1 3 - 1 0 - 3 4 ; / h 4 - 7 , 1 4 - 1 9 H , 8 - 1 3 H 2 , 1 - 3 H 3 , ( H 3 , 3 5 , 3 6 ) ( H , 3 7 , 4 6 ) ( H , 3 8 , 4 5 ) ( H , 3 9 , 4 8 ) ( H , 4 0 , 4 7 ) ; 1 H |
| InChIKey |
B L S O A T W W A G I R G E - U H F F F A O Y S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Antagonist | CXCR2 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
