CDPPB
SMILES | N#Cc1cccc(c1)C(=O)Nc1cc(nn1c1ccccc1)c1ccccc1 |
InChIKey | BKUIZWILNWHFHD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 364.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Ligand site mutations | mGlu5 |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
BB2 | GRPR | Human | Bombesin | A | pKi | 6.67 | 6.72 | 6.77 | Guide to Pharmacology |
BB2 | GRPR | Rat | Bombesin | A | pKi | 5.0 | 5.0 | 5.0 | Guide to Pharmacology |
BB1 | NMBR | Rat | Bombesin | A | pKi | 6.66 | 6.94 | 7.23 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
BB1 | NMBR | Human | Bombesin | A | pIC50 | 6.22 | 6.39 | 6.56 | Guide to Pharmacology |
BB2 | GRPR | Human | Bombesin | A | pIC50 | 5.34 | 5.47 | 5.61 | Guide to Pharmacology |
BB3 | BRS3 | Human | Bombesin | A | pIC50 | 5.6 | 5.6 | 5.6 | Guide to Pharmacology |
BB1 | NMBR | Rat | Bombesin | A | pIC50 | 6.0 | 6.0 | 6.0 | Guide to Pharmacology |