CHEMBL3695253
SMILES | O=C(O)C1(O)CCN(c2nc3ccccc3n([C@@H]3C[C@@H]4CC[C@H](C3)N4C3CCCCCCC3)c2=O)CC1 |
InChIKey | RAJONVKVKIRPNJ-JKHIJQBDSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 508.3 |
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 | 4.79 | 4.79 | 4.79 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 6.06 | 6.06 | 6.06 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 6.14 | 6.14 | 6.14 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |