Ligand Data
Ligand
| Name | iperoxo |
| SMILES | C[N+](CC#CCOC1=NOCC1)(C)C |
| InChIKey | WXXOCGISBCTWPW-UHFFFAOYSA-N |
| Type | small-molecule |
| External Links | |
| Structure pdb | 4MQS 4MQT 6OIK 6OIJ |
Structure
Properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 2 |
| Molecular weight | 197.1 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
| M2 | Q8VH27 | Guinea pig | Acetylcholine (muscarinic) | A (Rhodopsin) | 0.1 | 0.1 | 0.2 | |||
| M2 | ACM2 | Human | Acetylcholine (muscarinic) | A (Rhodopsin) | 2.2 | 56.6 | 257.0 | 0.3 | 0.3 | 0.3 |
| M1 | ACM1 | Human | Acetylcholine (muscarinic) | A (Rhodopsin) | 1.3 | 829.7 | 2138.0 | 2.0 | 2.0 | 2.0 |