CHEMBL4165748
SMILES | COc1ccc(-c2ccccc2-c2csc(N(C(=O)[C@@H](CC(=O)O)CC(C)C)C3CC3)n2)cn1 |
InChIKey | YQPPLQQLIGRTBF-GOSISDBHSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 10 |
Molecular weight (Da) | 479.2 |
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 |
FFA2 | FFAR2 | Human | Free fatty acid | A | pKi | 6.6 | 6.6 | 6.6 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
FFA2 | FFAR2 | Mouse | Free fatty acid | A | pEC50 | 6.9 | 6.9 | 6.9 | ChEMBL |
FFA2 | FFAR2 | Human | Free fatty acid | A | pEC50 | 7.6 | 7.6 | 7.6 | ChEMBL |