morphine
| SMILES | O[C@H]1C=C[C@@H]2[C@@]34[C@H]1Oc1c4c(C[C@H]2N(CC3)C)ccc1O |
| InChIKey | BQJCRHHNABKAKU-KBQPJGBKSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 0 |
| Molecular weight (Da) | 285.1 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | Yes |
Database connections
| Structure pdb | 8EF6 |
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pKi | 6.9 | 6.9 | 6.9 | Guide to Pharmacology |
| κ | OPRK | Human | Opioid | A | pKi | 7.3 | 7.3 | 7.3 | Guide to Pharmacology |
| μ | OPRM | Human | Opioid | A | pKi | 9.0 | 9.0 | 9.0 | Guide to Pharmacology |
| μ | OPRM | Rat | Opioid | A | pKi | 7.9 | 7.9 | 7.9 | Guide to Pharmacology |
| κ | OPRK | Rat | Opioid | A | pKi | 6.7 | 6.85 | 7.0 | Guide to Pharmacology |
| δ | O57585 | Zebrafish | Opioid | A | pKi | 6.65 | 6.65 | 6.65 | ChEMBL |
| κ | OPRK | Rat | Opioid | A | pKi | 6.95 | 7.16 | 7.57 | ChEMBL |
| κ | OPRK | Mouse | Opioid | A | pKi | 5.81 | 6.16 | 6.52 | ChEMBL |
| μ | OPRM | Mouse | Opioid | A | pKi | 8.34 | 8.73 | 8.92 | ChEMBL |
| δ | OPRD | Mouse | Opioid | A | pKi | 7.0 | 7.0 | 7.0 | ChEMBL |
| κ | OPRK | Guinea pig | Opioid | A | pKi | 5.19 | 6.9 | 7.62 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pKi | 6.93 | 8.34 | 9.11 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 6.15 | 6.61 | 7.29 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 5.72 | 7.12 | 8.16 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 7.42 | 8.57 | 9.85 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 8.18 | 8.18 | 8.18 | Drug Central |
| κ | OPRK | Human | Opioid | A | pKi | 8.16 | 8.16 | 8.16 | Drug Central |
| μ | OPRM | Rat | Opioid | A | pKi | 8.04 | 8.04 | 8.04 | Drug Central |
| μ | OPRM | Bovine | Opioid | A | pKi | 8.03 | 8.03 | 8.03 | Drug Central |
| κ | OPRK | Mouse | Opioid | A | pKi | 8.19 | 8.19 | 8.19 | Drug Central |
| κ | OPRK | Rat | Opioid | A | pKi | 8.12 | 8.12 | 8.12 | Drug Central |
| κ | OPRK | Guinea pig | Opioid | A | pKi | 8.12 | 8.12 | 8.12 | Drug Central |
| NOP | OPRX | Guinea pig | Opioid | A | pKi | 8.1 | 8.1 | 8.1 | Drug Central |
| μ | OPRM | Mouse | Opioid | A | pKi | 8.05 | 8.05 | 8.05 | Drug Central |
| δ | O57585 | Zebrafish | Opioid | A | pKi | 8.18 | 8.18 | 8.18 | Drug Central |
| δ | OPRD | Mouse | Opioid | A | pKi | 8.15 | 8.15 | 8.15 | Drug Central |
| μ | OPRM | Bovine | Opioid | A | pKi | 8.6 | 8.98 | 9.3 | ChEMBL |
| NOP | OPRX | Guinea pig | Opioid | A | pKi | 7.86 | 7.86 | 7.86 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| κ | OPRK | Mouse | Opioid | A | pEC50 | 6.4 | 6.4 | 6.4 | ChEMBL |
| κ | OPRK | Mouse | Opioid | A | pIC50 | 6.84 | 6.84 | 6.84 | ChEMBL |
| μ | OPRM | Mouse | Opioid | A | pIC50 | 5.85 | 7.39 | 8.9 | ChEMBL |
| μ | OPRM | Mouse | Opioid | A | pEC50 | 6.4 | 6.98 | 7.52 | ChEMBL |
| δ | OPRD | Mouse | Opioid | A | pIC50 | 5.8 | 6.27 | 6.81 | ChEMBL |
| κ | OPRK | Guinea pig | Opioid | A | pIC50 | 5.62 | 6.63 | 8.74 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pIC50 | 5.01 | 8.25 | 9.85 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pEC50 | 6.71 | 6.97 | 7.67 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pIC50 | 6.37 | 6.64 | 6.82 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pEC50 | 6.11 | 6.72 | 7.81 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pIC50 | 5.77 | 6.21 | 6.66 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pEC50 | 6.32 | 6.36 | 6.48 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pIC50 | 6.39 | 8.07 | 9.24 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 6.3 | 7.35 | 8.43 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 8.1 | 8.1 | 8.1 | Drug Central |