Stem definition | Drug id | CAS RN |
---|---|---|
anti-inflammatory analgesics, phenylbutazone derivatives | 171 | 58-15-1 |
Dose | Unit | Route |
---|---|---|
0.50 | g | R |
Property | Value | Reference |
---|---|---|
BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Benet LZ, Broccatelli F, Oprea TI |
S (Water solubility) | 55.55 mg/mL | Benet LZ, Broccatelli F, Oprea TI |
MRTD (Maximum Recommended Therapeutic Daily Dose) | 247.05 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
Date | Agency | Company | Orphan |
---|---|---|---|
Jan. 1, 1964 | YEAR INTRODUCED |
None
None
None
None
Source | Code | Description |
---|---|---|
ATC | N02BB03 | NERVOUS SYSTEM ANALGESICS OTHER ANALGESICS AND ANTIPYRETICS Pyrazolones |
ATC | N02BB53 | NERVOUS SYSTEM ANALGESICS OTHER ANALGESICS AND ANTIPYRETICS Pyrazolones |
ATC | N02BB73 | NERVOUS SYSTEM ANALGESICS OTHER ANALGESICS AND ANTIPYRETICS Pyrazolones |
MeSH PA | D000700 | Analgesics |
MeSH PA | D018712 | Analgesics, Non-Narcotic |
MeSH PA | D000893 | Anti-Inflammatory Agents |
MeSH PA | D000894 | Anti-Inflammatory Agents, Non-Steroidal |
MeSH PA | D018501 | Antirheumatic Agents |
MeSH PA | D018373 | Peripheral Nervous System Agents |
MeSH PA | D018689 | Sensory System Agents |
CHEBI has role | CHEBI:35475 | non-steroidal anti-inflammatory agent |
CHEBI has role | CHEBI:35493 | anti-pyretic |
CHEBI has role | CHEBI:35703 | Xenobiotic |
CHEBI has role | CHEBI:78298 | environmental contaminants |
None
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 5.06 | Basic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Prostaglandin G/H synthase 2 | Enzyme | WOMBAT-PK | |||||||
Prostaglandin G/H synthase 1 | Enzyme | WOMBAT-PK | |||||||
Nicotinate phosphoribosyltransferase | Enzyme | Ki | 9 | CHEMBL |
ID | Source |
---|---|
N0000167058 | NUI |
D00556 | KEGG_DRUG |
695 | RXNORM |
C0002586 | UMLSCUI |
CHEBI:160246 | CHEBI |
CHEMBL288470 | ChEMBL_ID |
DB01424 | DRUGBANK_ID |
6009 | PUBCHEM_CID |
375 | INN_ID |
01704YP3MO | UNII |
65458000 | SNOMEDCT_US |
D000632 | MESH_DESCRIPTOR_UI |
D000983 | MESH_DESCRIPTOR_UI |
001608 | NDDF |
None