| Collection |
D4 : TTD |
| Chemical Name |
SB-227931 ( From PubChem : C H E M B L 3 7 1 7 2 0 ) |
| 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 |
| 549.366 g/mol |
1 |
6 |
5.82226 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 4 H 2 0 I N 7 O / c 2 5 - 2 0 - 7 - 5 - 1 8 ( 6 - 8 - 2 0 ) 2 4 ( 3 3 ) 2 8 - 1 1 - 2 - 1 4 - 3 2 - 1 6 - 2 9 - 2 2 ( 2 3 ( 3 2 ) 1 7 - 9 - 1 2 - 2 7 - 1 3 - 1 0 - 1 7 ) 1 9 - 3 - 1 - 4 - 2 1 ( 1 5 - 1 9 ) 3 0 - 3 1 - 2 6 / h 1 , 3 - 1 0 , 1 2 - 1 3 , 1 5 - 1 6 H , 2 , 1 1 , 1 4 H 2 , ( H , 2 8 , 3 3 ) |
| InChIKey |
L U M G X W H A S L Y P J W - 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 | Inhibitor | MAPK14 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
