CHEMBL259185
SMILES | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 |
InChIKey | NXTWTUDFHBDVOS-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 368.1 |
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 |
NOP | OPRX | Human | Opioid | A | pIC50 | 7.68 | 7.72 | 7.77 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 6.92 | 6.92 | 6.92 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 5.36 | 5.36 | 5.36 | ChEMBL |