CHEMBL1076724
SMILES | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCC/C=C/CCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C |
InChIKey | QUUTWUNCRLZYFR-WDNYOLFRSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 6 |
Rotatable bonds | 14 |
Molecular weight (Da) | 814.4 |
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 |
μ | OPRM | Rat | Opioid | A | pKi | 8.82 | 8.82 | 8.82 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKd | 8.31 | 8.31 | 8.31 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |