Stem definition | Drug id | CAS RN |
---|---|---|
1526 | 469-79-4 |
Dose | Unit | Route |
---|---|---|
50 | mg | O |
50 | mg | P |
Property | Value | Reference |
---|---|---|
MRTD (Maximum Recommended Therapeutic Daily Dose) | 3.47 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
BA (Bioavailability) | 34 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
Vd (Volume of distribution) | 0.48 L/kg | Lombardo F, Berellini G, Obach RS |
CL (Clearance) | 9.20 mL/min/kg | Lombardo F, Berellini G, Obach RS |
t_half (Half-life) | 2.30 hours | Lombardo F, Berellini G, Obach RS |
BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Bocci G, Oprea TI, Benet LZ |
Date | Agency | Company | Orphan |
---|---|---|---|
Jan. 1, 1947 | YEAR INTRODUCED |
None
None
None
None
Source | Code | Description |
---|---|---|
ATC | N02AB01 | NERVOUS SYSTEM ANALGESICS OPIOIDS Phenylpiperidine derivatives |
ATC | N02AG02 | NERVOUS SYSTEM ANALGESICS OPIOIDS Opioids in combination with antispasmodics |
MeSH PA | D000700 | Analgesics |
MeSH PA | D000701 | Analgesics, Opioid |
MeSH PA | D002491 | Central Nervous System Agents |
MeSH PA | D002492 | Central Nervous System Depressants |
MeSH PA | D018691 | Excitatory Amino Acid Antagonists |
MeSH PA | D009294 | Narcotics |
MeSH PA | D018377 | Neurotransmitter Agents |
MeSH PA | D018373 | Peripheral Nervous System Agents |
MeSH PA | D018689 | Sensory System Agents |
None
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 9.35 | acidic |
pKa2 | 8.84 | Basic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Mu-type opioid receptor | GPCR | EC50 | 9 | WOMBAT-PK | |||||
Kappa-type opioid receptor | GPCR | Ki | 6.22 | WOMBAT-PK | |||||
Glutamate receptor ionotropic, NMDA 3A | Ion channel | Ki | 4.59 | WOMBAT-PK | |||||
Delta-type opioid receptor | GPCR | Ki | 6.85 | WOMBAT-PK | |||||
Opioid receptor | GPCR | EC50 | 8.70 | CHEMBL | |||||
Opioid receptor | GPCR | IC50 | 5.15 | CHEMBL |
ID | Source |
---|---|
D08100 | KEGG_DRUG |
C0064311 | UMLSCUI |
CHEBI:6125 | CHEBI |
CHEMBL47072 | ChEMBL_ID |
CHEMBL259124 | ChEMBL_ID |
DB06738 | DRUGBANK_ID |
C012394 | MESH_SUPPLEMENTAL_RECORD_UI |
10101 | PUBCHEM_CID |
1274 | INN_ID |
PQS1L514CF | UNII |
015273 | NDDF |
96190002 | SNOMEDCT_US |
None