CHEMBL108130
SMILES | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 |
InChIKey | GAUFCDPHSYEFLM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 591.2 |
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 |
CCK1 | CCKAR | Rat | Cholecystokinin | A | pIC50 | 7.3 | 7.3 | 7.3 | ChEMBL |
CCK2 | GASR | Human | Cholecystokinin | A | pIC50 | 7.3 | 7.3 | 7.3 | ChEMBL |
CCK1 | CCKAR | Human | Cholecystokinin | A | pIC50 | 7.1 | 7.1 | 7.1 | ChEMBL |