CHEMBL4795763
SMILES | CC#C[C@@H](CC(=O)O)c1ccc(OCc2ncc(CN3CCC4(C=Cc5ccccc54)CC3)s2)cc1 |
InChIKey | QBQDRXNVVTZECL-DEOSSOPVSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 498.2 |
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 |
FFA1 | FFAR1 | Human | Free fatty acid | A | pKi | 6.89 | 6.89 | 6.89 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
FFA1 | FFAR1 | Mouse | Free fatty acid | A | pEC50 | 8.14 | 8.14 | 8.14 | ChEMBL |
FFA1 | FFAR1 | Rat | Free fatty acid | A | pEC50 | 7.64 | 7.64 | 7.64 | ChEMBL |
FFA1 | FFAR1 | Human | Free fatty acid | A | pEC50 | 7.08 | 7.85 | 8.55 | ChEMBL |