CHEMBL2023114
SMILES | CNC(=O)C1(c2cccc3c2N(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)Cc2ccc(C(F)(F)F)nc2N3)CCC1 |
InChIKey | JQNQSUZSXLYJGX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 5 |
Molecular weight (Da) | 600.1 |
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 | 7.66 | 7.66 | 7.66 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pIC50 | 8.68 | 8.68 | 8.68 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pEC50 | 7.82 | 7.82 | 7.82 | ChEMBL |