CHEMBL4129679
SMILES | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O |
InChIKey | TUHRBBXHPLITAF-ZRBLBEILSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 9 |
Rotatable bonds | 15 |
Molecular weight (Da) | 569.3 |
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 | Mouse | Opioid | A | pIC50 | 7.85 | 8.68 | 9.5 | ChEMBL |
μ | OPRM | Mouse | Opioid | A | pIC50 | 10.0 | 10.0 | 10.0 | ChEMBL |