| Collection |
D4 : TTD |
| Chemical Name |
RPR-120844 ( From PubChem : R P R - 1 2 0 8 4 4 ) |
| 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 |
| 472.58 g/mol |
2 |
9 |
4.4343 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 2 4 N 4 O 4 S 2 / c 1 - 2 5 ( 1 9 - 7 - 8 - 2 6 ( 2 2 ( 1 9 ) 2 7 ) 1 2 - 1 4 - 9 - 2 0 ( 2 1 ( 2 3 ) 2 4 ) 3 1 - 1 3 - 1 4 ) 3 2 ( 2 8 , 2 9 ) 1 8 - 6 - 4 - 1 5 - 3 - 5 - 1 7 ( 3 0 - 2 ) 1 0 - 1 6 ( 1 5 ) 1 1 - 1 8 / h 3 - 6 , 9 - 1 1 , 1 3 , 1 9 H , 7 - 8 , 1 2 H 2 , 1 - 2 H 3 , ( H 3 , 2 3 , 2 4 ) / t 1 9 - / m 0 / s 1 |
| InChIKey |
Y Q Y Y T N C S S D R J H Z - I B G Z P J M E S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | PROC | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
