CHEMBL2179475
SMILES | Cc1ccc2c(c1C)N(S(=O)(=O)c1ccc(S(C)(=O)=O)cc1)Cc1ccc(C(F)(F)F)nc1N2 |
InChIKey | JQRBMCDLOPKBNY-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 511.1 |
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 | 6.25 | 6.25 | 6.25 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pEC50 | 6.26 | 6.26 | 6.26 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pIC50 | 7.14 | 7.14 | 7.14 | ChEMBL |