CHEMBL1087066
| SMILES | CCC(C)(C)Cc1c[nH]c(CCc2ccc(-c3ccccc3OCc3nc(C(F)(F)F)n[nH]3)cc2)n1 |
| InChIKey | YINMOVMVQPJVPT-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 10 |
| Molecular weight (Da) | 497.2 |
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 |
| BB3 | BRS3 | Mouse | Bombesin | A | pEC50 | 7.92 | 7.92 | 7.92 | ChEMBL |
| BB3 | BRS3 | Human | Bombesin | A | pIC50 | 6.9 | 6.9 | 6.9 | ChEMBL |
| BB3 | BRS3 | Human | Bombesin | A | pEC50 | 6.89 | 6.89 | 6.89 | ChEMBL |