| Collection |
D4 : TTD |
| Chemical Name |
ATC-0175 ( From PubChem : A T C - 0 1 7 5 ) |
| 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 |
| 425.474 g/mol |
2 |
6 |
4.591 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 3 H 2 5 F 2 N 5 O / c 1 - 3 0 ( 2 ) 2 1 - 1 7 - 5 - 3 - 4 - 6 - 2 0 ( 1 7 ) 2 8 - 2 3 ( 2 9 - 2 1 ) 2 7 - 1 6 - 1 0 - 8 - 1 5 ( 9 - 1 1 - 1 6 ) 2 6 - 2 2 ( 3 1 ) 1 4 - 7 - 1 2 - 1 8 ( 2 4 ) 1 9 ( 2 5 ) 1 3 - 1 4 / h 3 - 7 , 1 2 - 1 3 , 1 5 - 1 6 H , 8 - 1 1 H 2 , 1 - 2 H 3 , ( H , 2 6 , 3 1 ) ( H , 2 7 , 2 8 , 2 9 ) / t 1 5 - , 1 6 - |
| InChIKey |
F A I M G W S O S C F G R U - W K I L W M F I S A - N
|
| Links |
|
Gene
(7 /
8)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ADRA1A | | | Clinical trial target | | TTD | Inhibitor | ADRA2A | | | Successful target | | TTD | Inhibitor | HRH1 | | | Successful target | | TTD | Inhibitor | HTR1A | | | Successful target | | TTD | Inhibitor | HTR2B | | | Successful target | | TTD | Inhibitor | MCHR1 | | | Discontinued target | | TTD | Inhibitor | NPY5R | | | Clinical trial target | | ChEMBL | Activity | - | | HTR2B
| - |  | Target : CHEMBL1833 |
|
| Download gene sets |
gmt, text, Detailed text
|
