CHEMBL1777868
SMILES | CC#CC(CC(=O)O)c1ccc(Oc2nccnc2C#N)cc1 |
InChIKey | QPIICQXBXFBNLV-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 307.1 |
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 |
FFA1 | FFAR1 | Mouse | Free fatty acid | A | pEC50 | 6.01 | 6.01 | 6.01 | ChEMBL |
FFA1 | FFAR1 | Human | Free fatty acid | A | pIC50 | 5.6 | 5.6 | 5.6 | ChEMBL |
FFA1 | FFAR1 | Human | Free fatty acid | A | pEC50 | 5.8 | 5.8 | 5.8 | ChEMBL |