CHEMBL2179912
SMILES | CC(C)(C)c1ccc(S(=O)(=O)N2Cc3ccc(C(F)(F)F)nc3Nc3cccc(Cl)c32)cc1 |
InChIKey | CBQIYLKRMLUSFL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 495.1 |
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 | 7.2 | 7.2 | 7.2 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pIC50 | 8.49 | 8.49 | 8.49 | ChEMBL |