Ligand Data
Ligand
| Name | CHEMBL1332346 |
| SMILES | COC(=O)[C@@]1(Cc2ccc(F)cc2)[C@H]2c3cc(C(=O)N(C)C)n(Cc4ccccc4)c3C[C@H]2CN1C(=O)c1ccccc1 |
| InChIKey | YOHQXMCAKJZZPA-XRCYRVQWSA-N |
| Type | small-molecule |
| External Links |
Structure
Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 7 |
| Molecular weight | 579.3 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
| NPBW1 | NPBW1 | Human | Neuropeptide W/neuropeptide B | A (Rhodopsin) | 16295 | 16295 | 16295 | |||
| MCH1 | MCHR1 | Human | Melanin-concentrating hormone | A (Rhodopsin) | 11115 | 11115 | 11115 | |||
| TSH | TSHR | Human | Glycoprotein hormone | A (Rhodopsin) | 10000 | 10000 | 10000 | |||