CHEMBL4791842
SMILES | CC#C[C@@H](CC(=O)O)c1ccc(OCc2ccc(CN3CCC4(CCc5ccccc54)CC3)cc2)cc1 |
InChIKey | WKVVLTUTCPYXBP-LJAQVGFWSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 493.3 |
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 |
FFA1 | FFAR1 | Human | Free fatty acid | A | pKi | 8.34 | 8.34 | 8.34 | ChEMBL |
FFA1 | FFAR1 | Human | Free fatty acid | A | pKd | 8.66 | 8.66 | 8.66 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
FFA1 | FFAR1 | Mouse | Free fatty acid | A | pEC50 | 9.06 | 9.06 | 9.06 | ChEMBL |
FFA1 | FFAR1 | Rat | Free fatty acid | A | pEC50 | 8.89 | 8.89 | 8.89 | ChEMBL |
FFA1 | FFAR1 | Human | Free fatty acid | A | pEC50 | 7.72 | 7.96 | 8.21 | ChEMBL |