CHEMBL1311570
SMILES | Brc1ccc(CSc2nnc(-c3ccccn3)n2Cc2ccco2)cc1 |
InChIKey | LUJCSBDPIKBOMN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 426.0 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 |
Y2 | NPY2R | Human | Neuropeptide Y | A | pIC50 | 5.09 | 5.09 | 5.09 | ChEMBL |
Y1 | NPY1R | Human | Neuropeptide Y | A | pIC50 | 5.13 | 5.13 | 5.13 | ChEMBL |
κ | OPRK | Human | Opioid | A | pEC50 | 5.25 | 5.64 | 5.87 | ChEMBL |
TSH | TSHR | Human | Glycoprotein hormone | A | Potency | 4.4 | 4.4 | 4.4 | ChEMBL |