| Collection |
D4 : TTD |
| Chemical Name |
DMP-757 ( From PubChem : C H E M B L 6 5 6 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 |
| 574.629 g/mol |
7 |
15 |
0.6808 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 6 H 3 8 N 8 O 7 / c 1 - 1 4 ( 2 ) 2 1 - 2 5 ( 4 1 ) 3 4 ( 3 ) 1 8 ( 8 - 5 - 9 - 2 9 - 2 6 ( 2 7 ) 2 8 ) 2 4 ( 4 0 ) 3 1 - 1 3 - 1 9 ( 3 5 ) 3 2 - 1 7 ( 1 1 - 2 0 ( 3 6 ) 3 7 ) 2 3 ( 3 9 ) 3 0 - 1 2 - 1 5 - 6 - 4 - 7 - 1 6 ( 1 0 - 1 5 ) 2 2 ( 3 8 ) 3 3 - 2 1 / h 4 , 6 - 7 , 1 0 , 1 4 , 1 7 - 1 8 , 2 1 H , 5 , 8 - 9 , 1 1 - 1 3 H 2 , 1 - 3 H 3 , ( H , 3 0 , 3 9 ) ( H , 3 1 , 4 0 ) ( H , 3 2 , 3 5 ) ( H , 3 3 , 3 8 ) ( H , 3 6 , 3 7 ) ( H 4 , 2 7 , 2 8 , 2 9 ) / t 1 7 - , 1 8 - , 2 1 - / m 0 / s 1 |
| InChIKey |
T Z Z M W R L T T W M K C L - W F X M L N O X S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ITGB3 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
