Stem definition | Drug id | CAS RN |
---|---|---|
quaternary ammonium compounds | 988 | 312-48-1 |
None
Property | Value | Reference |
---|---|---|
BA (Bioavailability) | 0 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
Vd (Volume of distribution) | 1.10 L/kg | Lombardo F, Berellini G, Obach RS |
CL (Clearance) | 9.60 mL/min/kg | Lombardo F, Berellini G, Obach RS |
t_half (Half-life) | 1.80 hours | Lombardo F, Berellini G, Obach RS |
Date | Agency | Company | Orphan |
---|---|---|---|
May 3, 1951 | FDA |
None
None
None
None
Source | Code | Description |
---|---|---|
ATC | V04CX07 | VARIOUS DIAGNOSTIC AGENTS OTHER DIAGNOSTIC AGENTS Other diagnostic agents |
FDA MoA | N0000000177 | Cholinesterase Inhibitors |
CHEBI has role | CHEBI:33295 | diagnostic aid |
CHEBI has role | CHEBI:37733 | EC 3.1.1.8 inhibitor |
CHEBI has role | CHEBI:50247 | antidotes |
MeSH PA | D000931 | Antidotes |
MeSH PA | D018678 | Cholinergic Agents |
MeSH PA | D002800 | Cholinesterase Inhibitors |
MeSH PA | D004791 | Enzyme Inhibitors |
MeSH PA | D018377 | Neurotransmitter Agents |
MeSH PA | D020011 | Protective Agents |
FDA EPC | N0000175723 | Cholinesterase Inhibitor |
Disease | Relation | SNOMED_ID | DOID |
---|---|---|---|
Reversal of neuromuscular blockade | indication | 241703000 | |
Curare Overdose | indication | ||
Neuromuscular Block due to Nondepolarizing Drug | indication | ||
Diagnostic Test for Myasthenia Gravis | indication | ||
Brain damage | contraindication | 2470005 | |
Tachyarrhythmia | contraindication | 6285003 | |
Urinary tract obstruction | contraindication | 7163005 | DOID:5200 |
Severe chronic ulcerative colitis | contraindication | 14311001 | |
Toxic megacolon | contraindication | 28536002 | DOID:1770 |
Atony of colon | contraindication | 29479008 | |
Hyperthyroidism | contraindication | 34486009 | DOID:7998 |
Hypertensive disorder | contraindication | 38341003 | DOID:10763 |
Complete trisomy 21 syndrome | contraindication | 41040004 | DOID:14250 |
Conduction disorder of the heart | contraindication | 44808001 | |
Achalasia of esophagus | contraindication | 45564002 | DOID:9164 |
Chronic heart failure | contraindication | 48447003 | |
Paralytic ileus | contraindication | 55525008 | DOID:8442 |
Peptic reflux disease | contraindication | 57643001 | |
Ulcerative colitis | contraindication | 64766004 | DOID:8577 |
Drug AND/OR toxin-induced diarrhea | contraindication | 65979008 | |
Spastic paralysis | contraindication | 78403003 | |
Disturbance of salivary secretion | contraindication | 78948009 | |
Hiatal hernia | contraindication | 84089009 | DOID:12642 |
Kidney disease | contraindication | 90708001 | DOID:557 |
Myasthenia gravis | contraindication | 91637004 | DOID:437 |
Gastrointestinal obstruction | contraindication | 126765001 | |
Autonomic dysreflexia | contraindication | 129618003 | |
Bleeding | contraindication | 131148009 | |
Asthma | contraindication | 195967001 | DOID:2841 |
Myocardial dysfunction | contraindication | 233928007 | |
Disease of liver | contraindication | 235856003 | DOID:409 |
Bladder outflow obstruction | contraindication | 236645006 | |
Pyloric obstruction | contraindication | 244815007 | |
Benign prostatic hyperplasia | contraindication | 266569009 | |
Retention of urine | contraindication | 267064002 | |
Drowsy | contraindication | 271782001 | |
Angle-closure glaucoma | contraindication | 392291006 | DOID:13550 |
Gastric ulcer | contraindication | 397825006 | DOID:10808 |
Chronic lung disease | contraindication | 413839001 | |
Disorder of coronary artery | contraindication | 414024009 |
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 7.87 | acidic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Acetylcholinesterase | Enzyme | INHIBITOR | Ki | 8.79 | CHEMBL | CHEMBL | |||
Acetylcholinesterase | Enzyme | Ki | 6.70 | CHEMBL |
ID | Source |
---|---|
4019741 | VUID |
N0000147833 | NUI |
D00994 | KEGG_DRUG |
116-38-1 | SECONDARY_CAS_RN |
4017810 | VANDF |
4019741 | VANDF |
C0013615 | UMLSCUI |
CHEBI:251408 | CHEBI |
CHEMBL60745 | ChEMBL_ID |
CHEMBL1104 | ChEMBL_ID |
DB01010 | DRUGBANK_ID |
CHEMBL1128 | ChEMBL_ID |
D004491 | MESH_DESCRIPTOR_UI |
3202 | PUBCHEM_CID |
9073 | IUPHAR_LIGAND_ID |
70FP3JLY7N | UNII |
3752 | RXNORM |
41678 | MMSL |
4653 | MMSL |
d00220 | MMSL |
001708 | NDDF |
004688 | NDDF |
11504003 | SNOMEDCT_US |
373342004 | SNOMEDCT_US |
46913003 | SNOMEDCT_US |
EDR | PDB_CHEM_ID |
187 | INN_ID |
None