CHEMBL1583665
SMILES | CCOc1ccc(/C=C/[N+](=O)[O-])c2ccccc12 |
InChIKey | SHTYEDHRCHTDDY-MDZDMXLPSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 243.1 |
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 |
CCR6 | CCR6 | Human | Chemokine | A | pIC50 | 4.56 | 4.56 | 4.56 | ChEMBL |
NTS1 | NTR1 | Human | Neurotensin | A | pEC50 | 5.02 | 5.02 | 5.02 | ChEMBL |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 5.0 | 5.0 | 5.0 | ChEMBL |