| Collection |
D4 : TTD |
| Chemical Name |
BMS-262084 ( From PubChem : B M S - 2 6 2 0 8 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 |
| 425.483 g/mol |
4 |
12 |
0.8025 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 8 H 3 1 N 7 O 5 / c 1 - 1 8 ( 2 , 3 ) 2 2 - 1 6 ( 2 9 ) 2 3 - 7 - 9 - 2 4 ( 1 0 - 8 - 2 3 ) 1 7 ( 3 0 ) 2 5 - 1 2 ( 1 4 ( 2 7 ) 2 8 ) 1 1 ( 1 3 ( 2 5 ) 2 6 ) 5 - 4 - 6 - 2 1 - 1 5 ( 1 9 ) 2 0 / h 1 1 - 1 2 H , 4 - 1 0 H 2 , 1 - 3 H 3 , ( H , 2 2 , 2 9 ) ( H , 2 7 , 2 8 ) ( H 4 , 1 9 , 2 0 , 2 1 ) / t 1 1 - , 1 2 + / m 1 / s 1 |
| InChIKey |
M F T Q I T S P G Q O R D A - N E P J U H H U S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | TPSD1 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
