CHEMBL1762252
SMILES | O=C(NC12CC3CC(CC(C3)C1)C2)NS(=O)(=O)c1cnccc1N[C@@H]1C[C@H]2CC[C@@H]1C2 |
InChIKey | JWRIWXMEJYFPGI-AVDPDVQASA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 5 |
Molecular weight (Da) | 444.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
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 | 7.41 | 7.41 | 7.41 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pIC50 | 6.51 | 6.51 | 6.51 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pEC50 | 6.66 | 6.66 | 6.66 | ChEMBL |