CHEMBL2179480
| SMILES | Cc1ccc2c(c1C)N(S(=O)(=O)c1ccc(C(F)(F)F)s1)Cc1ccc(C(F)(F)F)nc1N2 |
| InChIKey | XVQFCORZELNGNH-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 507.1 |
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 | 6.81 | 6.81 | 6.81 | ChEMBL |
| BB3 | BRS3 | Human | Bombesin | A | pEC50 | 6.8 | 6.8 | 6.8 | ChEMBL |
| BB3 | BRS3 | Human | Bombesin | A | pIC50 | 8.0 | 8.0 | 8.0 | ChEMBL |