CHEMBL1762270
SMILES | CC(C)(C)c1csc(NS(=O)(=O)c2cnccc2N[C@@H]2C[C@H]3CC[C@@H]2C3)n1 |
InChIKey | INGOGTFUMZGBBN-GZBFAFLISA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 5 |
Molecular weight (Da) | 406.2 |
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 | Human | Bombesin | A | pIC50 | 5.6 | 5.6 | 5.6 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pEC50 | 5.68 | 5.68 | 5.68 | ChEMBL |
BB3 | BRS3 | Mouse | Bombesin | A | pEC50 | 6.7 | 6.7 | 6.7 | ChEMBL |