CHEMBL1534919
| SMILES | COc1ccc(OC)c(C2C3=C(O)CCCC3=NC(C)=C2C(=O)Nc2nc3ccccc3s2)c1 |
| InChIKey | GFQYCJDJPSVRDG-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 475.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | Potency | 5.15 | 5.15 | 5.15 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pIC50 | 4.9 | 4.9 | 4.9 | ChEMBL |
| NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 5.5 | 5.53 | 5.55 | ChEMBL |