CHEMBL1336535
SMILES | COc1ccc(-c2nnc(NC(=O)c3ccc(F)cc3)o2)cc1 |
InChIKey | PYEOEQNWKWVZFZ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 313.1 |
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 |
κ | OPRK | Human | Opioid | A | pIC50 | 4.97 | 4.97 | 4.97 | ChEMBL |
CCR6 | CCR6 | Human | Chemokine | A | pIC50 | 4.77 | 4.77 | 4.77 | ChEMBL |