| Collection |
D4 : TTD |
| Chemical Name |
COSALANE ( From PubChem : C O S A L A N 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 |
| 767.86 g/mol |
4 |
6 |
12.7504 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 4 5 H 6 0 C l 2 O 6 / c 1 - 2 5 ( 2 ) 8 - 6 - 9 - 2 6 ( 3 ) 3 5 - 1 4 - 1 5 - 3 6 - 3 2 - 1 3 - 1 2 - 3 0 - 2 0 - 2 7 ( 1 6 - 1 8 - 4 4 ( 3 0 , 4 ) 3 7 ( 3 2 ) 1 7 - 1 9 - 4 5 ( 3 5 , 3 6 ) 5 ) 1 0 - 7 - 1 1 - 3 1 ( 2 8 - 2 1 - 3 3 ( 4 2 ( 5 0 ) 5 1 ) 4 0 ( 4 8 ) 3 8 ( 4 6 ) 2 3 - 2 8 ) 2 9 - 2 2 - 3 4 ( 4 3 ( 5 2 ) 5 3 ) 4 1 ( 4 9 ) 3 9 ( 4 7 ) 2 4 - 2 9 / h 1 1 , 2 1 - 2 7 , 3 0 , 3 2 , 3 5 - 3 7 , 4 8 - 4 9 H , 6 - 1 0 , 1 2 - 2 0 H 2 , 1 - 5 H 3 , ( H , 5 0 , 5 1 ) ( H , 5 2 , 5 3 ) / t 2 6 ? , 2 7 - , 3 0 ? , 3 2 ? , 3 5 + , 3 6 ? , 3 7 ? , 4 4 - , 4 5 + / m 0 / s 1 |
| InChIKey |
V O J O O G P A L C A T L T - M J Z F B S O M S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CCR1 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
