CHEMBL1309871
SMILES | O=C(NNC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1)c1ccccc1 |
InChIKey | BWSDYKXKOONUOR-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 382.1 |
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 |
apelin | APJ | Human | Apelin | A | pIC50 | 4.83 | 4.83 | 4.83 | ChEMBL |
CCR6 | CCR6 | Human | Chemokine | A | pIC50 | 4.59 | 4.81 | 5.03 | ChEMBL |
CXCR5 | CXCR5 | Human | Chemokine | A | pIC50 | 4.9 | 4.9 | 4.9 | ChEMBL |