ADL5747
SMILES | CCN(C(=O)c1ccc(c(c1)O)C1=CC2(CCNCC2)Oc2c1cccc2)CC |
InChIKey | ALGHKWSXJUQNJJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 392.2 |
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 | 8.57 | 8.57 | 8.57 | Guide to Pharmacology |
μ | OPRM | Human | Opioid | A | pKi | 7.74 | 7.74 | 7.74 | Guide to Pharmacology |
δ | OPRD | Human | Opioid | A | pKi | 8.57 | 8.57 | 8.57 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.6 | 7.6 | 7.6 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pEC50 | 7.03 | 7.03 | 7.03 | ChEMBL |