lorglumide
SMILES | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC |
InChIKey | IEKOTSCYBBDIJC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 14 |
Molecular weight (Da) | 458.2 |
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 |
CCK1 | CCKAR | Rat | Cholecystokinin | A | pKi | 6.89 | 6.89 | 6.89 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CCK2 | GASR | Human | Cholecystokinin | A | pIC50 | 5.5 | 5.5 | 5.5 | Guide to Pharmacology |
CCK1 | CCKAR | Rat | Cholecystokinin | A | pIC50 | 6.7 | 7.45 | 8.2 | Guide to Pharmacology |
CCK2 | GASR | Rat | Cholecystokinin | A | pIC50 | 5.52 | 5.52 | 5.52 | ChEMBL |
CCK1 | CCKAR | Guinea pig | Cholecystokinin | A | pIC50 | 5.66 | 5.66 | 5.66 | ChEMBL |
CCK1 | CCKAR | Rat | Cholecystokinin | A | pIC50 | 6.77 | 7.37 | 7.75 | ChEMBL |
CCK2 | GASR | Human | Cholecystokinin | A | pIC50 | 4.6 | 5.16 | 5.72 | ChEMBL |