CHEMBL3597088
SMILES | CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(N)=O |
InChIKey | SLBDTDWDFNPFLS-SZBLEYPGSA-N |
Chemical properties
Hydrogen bond acceptors | 12 |
Hydrogen bond donors | 12 |
Rotatable bonds | 27 |
Molecular weight (Da) | 883.5 |
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 |
δ | OPRD | Human | Opioid | A | pKi | 8.18 | 8.18 | 8.18 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.41 | 7.41 | 7.41 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 8.42 | 8.42 | 8.42 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |