GW-5823
SMILES | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C |
InChIKey | LGYKPDHARJMLQN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 587.3 |
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 |
CCK2 | GASR | Human | Cholecystokinin | A | pIC50 | 6.0 | 6.0 | 6.0 | ChEMBL |
CCK1 | CCKAR | Human | Cholecystokinin | A | pIC50 | 7.64 | 7.64 | 7.64 | ChEMBL |
CCK1 | CCKAR | Human | Cholecystokinin | A | pIC50 | 7.6 | 7.6 | 7.6 | Guide to Pharmacology |
CCK2 | GASR | Human | Cholecystokinin | A | pIC50 | 6.0 | 6.0 | 6.0 | Guide to Pharmacology |