CHEMBL4170829
| SMILES | COc1ccc(-c2ccc(Cl)cc2-c2csc(N(C(=O)[C@@H](CC(=O)O)Cc3ccco3)C3CC3)n2)cn1 |
| InChIKey | AOZQVWPEWUHYNS-QGZVFWFLSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 10 |
| Molecular weight (Da) | 537.1 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| FFA2 | FFAR2 | Human | Free fatty acid | A | pKi | 7.0 | 7.0 | 7.0 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| FFA2 | FFAR2 | Mouse | Free fatty acid | A | pEC50 | 7.3 | 7.3 | 7.3 | ChEMBL |
| FFA2 | FFAR2 | Human | Free fatty acid | A | pEC50 | 7.9 | 7.9 | 7.9 | ChEMBL |