| Collection |
D4 : TTD |
| Chemical Name |
FR-230481 ( From PubChem : C H E M B L 1 6 7 9 9 1 ) |
| 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 |
| 537.713 g/mol |
3 |
7 |
5.4529 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 0 H 3 9 N 3 O 4 S / c 1 - 3 7 - 2 6 - 1 2 - 1 1 - 2 5 - 8 - 5 - 1 5 - 3 0 ( 3 4 , 2 8 ( 2 5 ) 2 0 - 2 6 ) 2 2 - 3 1 - 2 1 - 2 3 - 1 3 - 1 7 - 3 3 ( 1 8 - 1 4 - 2 3 ) 1 9 - 1 6 - 3 2 - 3 8 ( 3 5 , 3 6 ) 2 9 - 1 0 - 4 - 7 - 2 4 - 6 - 2 - 3 - 9 - 2 7 ( 2 4 ) 2 9 / h 2 - 4 , 6 - 7 , 9 - 1 2 , 2 0 , 2 3 , 3 1 - 3 2 , 3 4 H , 5 , 8 , 1 3 - 1 9 , 2 1 - 2 2 H 2 , 1 H 3 / t 3 0 - / m 1 / s 1 |
| InChIKey |
H R O M P G S H G X A F B Q - S S E X G K C C S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | NPY5R | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
