CHEMBL1578482
SMILES | Oc1cc(CSc2ccc(Cl)cc2)nc(-c2ccccn2)n1 |
InChIKey | IWNUQKTYIYGTEN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 329.0 |
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 |
AT1 | AGTR1 | Human | Angiotensin | A | pIC50 | 4.89 | 4.89 | 4.89 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 5.31 | 5.31 | 5.31 | ChEMBL |