CHEMBL1762382
SMILES | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 |
InChIKey | KCIAJHGLCXSCPG-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 10 |
Hydrogen bond donors | 6 |
Rotatable bonds | 19 |
Molecular weight (Da) | 878.4 |
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 | 7.25 | 7.25 | 7.25 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 5.96 | 5.96 | 5.96 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 5.8 | 5.8 | 5.8 | ChEMBL |