CHEMBL1390716
SMILES | Cc1[nH]c2ccccc2c1/C=C1\SC(=N)N(c2nccs2)C1=O |
InChIKey | RXQBEHGNWZBHIF-BPBFFJPSSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 2 |
Molecular weight (Da) | 340.0 |
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 |
δ | OPRD | Human | Opioid | A | pIC50 | 4.63 | 4.63 | 4.63 | ChEMBL |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 4.7 | 4.7 | 4.7 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 4.74 | 4.96 | 5.17 | ChEMBL |
AT1 | AGTR1 | Human | Angiotensin | A | pIC50 | 4.83 | 4.83 | 4.83 | ChEMBL |