| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2005 | 23 | Yes |
Popular Name: Oxycodone Oxycodone
(-)-14-Hydroxydihydrocodeinone
(5alpha)-14-hydroxy-17-methyl-3-(methyloxy)-4,5-epoxymorphinan-6-one
124-90-3; C08026; Oxycodone hydrochloride
124-90-3; D00847; Oxecta (TN); Oxycodone hydrochloride (USP); Oxycontin (TN); Roxicodone (TN)
14-hydroxy-3-methoxy-17-methyl-4,5alpha-epoxymorphinan-6-one
4,5-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one
4,5.alpha.-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one
4,5alpha-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one
Codeinone, 7,8-dihydro-14-hydroxy-
Codeinone, dihydro-14-hydroxy-
COMBUNOX; IBUPROFEN; LS-187985; OXYCODONE HYDROCHLORIDE
D05462; Oxycodone hydrochloride hydrate (JP16)
Morphinan-6-one, 4,5-alpha-epoxy-14-hydroxy-3-methoxy-17-methyl-
Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5alpha)-
Morphinan-6-one, 4,5alpha-epoxy-14-hydroxy-3-methoxy-17-methyl-
Morphinan-6-one, 4,5alpha-epoxy-14-hydroxy-3-methoxy-17-methyl- (8CI)
oxicodona; oxycodone; oxycodonum
Pancodone retard (United Kingdom)
USAN); Oxycodone Hydrochloride (JAN
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.79 | -1.05 | -59.43 | 2 | 5 | 1 | 60 | 316.377 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 5.59e+00 g/l | DrugBank-approved |
| PUBCHEM_PATENT_ID | EP0596903A1; EP0596903B1; EP0610357A1; EP0610357B1; US5071985; US5676968; WO1997025988A1 | IBM Patent Data |
| Patent Database Links | EP0889045; EP0908186; EP1323718; EP1518555; EP1535615; EP1557179; EP1584335; EP1604666; EP1604667; EP1639997; EP1685839; EP1695700; EP1700601; EP1741426; EP1774969; EP1776950; EP1782834; EP1785145; EP1797883; EP1810679; EP1813276; EP1815846; EP1820805; EP | ChEBI |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| OPRD-1-E | Delta Opioid Receptor (cluster #1 Of 3), Eukaryotic | Eukaryotes | 1087 | 0.36 | Binding ≤ 10μM |
| OPRK-1-E | Kappa Opioid Receptor (cluster #1 Of 6), Eukaryotic | Eukaryotes | 2658 | 0.34 | Binding ≤ 10μM |
| OPRM-1-E | Mu-type Opioid Receptor (cluster #1 Of 4), Eukaryotic | Eukaryotes | 44 | 0.45 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| OPRM_RAT | P33535 | Mu Opioid Receptor, Rat | 43.6 | 0.45 | Binding ≤ 1μM |
| OPRD_RAT | P33533 | Delta Opioid Receptor, Rat | 1087 | 0.36 | Binding ≤ 10μM |
| OPRK_RAT | P34975 | Kappa Opioid Receptor, Rat | 2658 | 0.34 | Binding ≤ 10μM |
| OPRM_RAT | P33535 | Mu Opioid Receptor, Rat | 43.6 | 0.45 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (i) signalling events | |
| G-protein activation | |
| Opioid Signalling | |
| Peptide ligand-binding receptors |
