Stem definition | Drug id | CAS RN |
---|---|---|
quaternary ammonium compounds | 146 | 7648-98-8 |
Dose | Unit | Route |
---|---|---|
60 | mg | O |
Property | Value | Reference |
---|---|---|
S (Water solubility) | 60.84 mg/mL | Bocci G, Oprea TI, Benet LZ |
BDDCS (Biopharmaceutical Drug Disposition Classification System) | 3 | Bocci G, Oprea TI, Benet LZ |
Date | Agency | Company | Orphan |
---|---|---|---|
May 1, 1956 | FDA | SANOFI AVENTIS US |
None
None
None
None
Source | Code | Description |
---|---|---|
ATC | N07AA30 | NERVOUS SYSTEM OTHER NERVOUS SYSTEM DRUGS PARASYMPATHOMIMETICS Anticholinesterases |
FDA MoA | N0000000177 | Cholinesterase Inhibitors |
CHEBI has role | CHEBI:37733 | EC 3.1.1.8 inhibitor |
CHEBI has role | CHEBI:35942 | neurotransmitter agents |
MeSH PA | D018678 | Cholinergic Agents |
MeSH PA | D002800 | Cholinesterase Inhibitors |
MeSH PA | D004791 | Enzyme Inhibitors |
MeSH PA | D018377 | Neurotransmitter Agents |
MeSH PA | D010277 | Parasympathomimetics |
MeSH PA | D018373 | Peripheral Nervous System Agents |
FDA EPC | N0000175723 | Cholinesterase Inhibitor |
Disease | Relation | SNOMED_ID | DOID |
---|---|---|---|
Myasthenia gravis | indication | 91637004 | DOID:437 |
Urinary tract obstruction | contraindication | 7163005 | DOID:5200 |
Parkinsonism | contraindication | 32798002 | |
Gastrointestinal obstruction | contraindication | 126765001 | |
Asthma | contraindication | 195967001 | DOID:2841 |
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 13.69 | acidic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Acetylcholinesterase | Enzyme | INHIBITOR | CHEMBL | CHEMBL | |||||
Acetylcholinesterase | Enzyme | Kd | 4.34 | CHEMBL | |||||
Acetylcholinesterase | Enzyme | IC50 | 9.92 | CHEMBL |
ID | Source |
---|---|
4022236 | VUID |
N0000020242 | NUI |
D01001 | KEGG_DRUG |
115-79-7 | SECONDARY_CAS_RN |
468764 | RXNORM |
C0002412 | UMLSCUI |
CHEBI:2627 | CHEBI |
CHEMBL1652 | ChEMBL_ID |
DB01122 | DRUGBANK_ID |
L16PUN799N | UNII |
2131 | PUBCHEM_CID |
2011 | MMSL |
4162 | MMSL |
d01420 | MMSL |
36537006 | SNOMEDCT_US |
387197009 | SNOMEDCT_US |
46887006 | SNOMEDCT_US |
D000549 | MESH_DESCRIPTOR_UI |
CHEMBL1200541 | ChEMBL_ID |
4018246 | VANDF |
4022236 | VANDF |
552 | INN_ID |
001706 | NDDF |
004686 | NDDF |
None