CHEMBL1269261
SMILES | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 |
InChIKey | YEXFDDZWQJXAEC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 556.3 |
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 | pEC50 | 6.53 | 6.53 | 6.53 | ChEMBL |
CCK1 | CCKAR | Rat | Cholecystokinin | A | pIC50 | 8.7 | 8.7 | 8.7 | ChEMBL |
CCK1 | CCKAR | Human | Cholecystokinin | A | pIC50 | 7.61 | 7.61 | 7.61 | ChEMBL |
CCK1 | CCKAR | Human | Cholecystokinin | A | pEC50 | 7.04 | 7.04 | 7.04 | ChEMBL |