| Collection |
D4 : TTD |
| Chemical Name |
DMP-802 ( From PubChem : C H E M B L 1 1 7 9 8 9 ) |
| 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 |
| 492.506 g/mol |
5 |
13 |
2.1047 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 0 H 2 4 N 6 O 7 S / c 1 - 1 0 - 1 8 ( 1 1 ( 2 ) 3 2 - 2 4 - 1 0 ) 3 4 ( 3 0 , 3 1 ) 2 6 - 1 6 ( 2 0 ( 2 8 ) 2 9 ) 9 - 2 3 - 1 7 ( 2 7 ) 8 - 1 4 - 7 - 1 5 ( 2 5 - 3 3 - 1 4 ) 1 2 - 3 - 5 - 1 3 ( 6 - 4 - 1 2 ) 1 9 ( 2 1 ) 2 2 / h 3 - 6 , 1 4 , 1 6 , 2 6 H , 7 - 9 H 2 , 1 - 2 H 3 , ( H 3 , 2 1 , 2 2 ) ( H , 2 3 , 2 7 ) ( H , 2 8 , 2 9 ) / t 1 4 - , 1 6 + / m 1 / s 1 |
| InChIKey |
X K F Y F S N O Q R U I A O - Z B F H G G J F 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
|
