Molecule Details
| InChIKey | KHOITXIGCFIULA-UHFFFAOYSA-N |
|---|---|
| Canonical SMILES | CC(=O)Oc1ccc(C(c2ccc(OC(C)=O)cc2)c2ccccn2)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.03 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB09020 |
|---|---|
| Drug Name | Bisacodyl |
| CAS Number | 603-50-9 |
| Groups | approved investigational |
| ATC Codes | A06AB52 A06AB02 A06AG02 |
| Description | Bisacodyl, a diphenylmethane derivative, is a commonly used over the counter stimulant laxative for occasional constipation.[A233300,L13362] Both bisacodyl and [picosulfate] are metabolized to the same active metabolite bis-(p-hydroxyphenyl)-pyridyl-2-methane (BHPM).[A233290,A233300,A207700] Bisacod... |
Categories: Alimentary Tract and Metabolism Benzene Derivatives Contact Laxatives Cresols Drugs for Constipation Enemas Gastrointestinal Agents Increased Large Intestinal Motility Laxatives Phenols Stimulation Large Intestine Fluid/Electrolyte Secretion
Cross-references: BindingDB: 61400 ChEBI: 3125 CHEMBL942 ChemSpider: 2299 Drugs Product Database (DPD): 10193 D00245 PubChem:2391 PubChem:310264977 RxCUI: 1596 Wikipedia: Bisacodyl ZINC: ZINC000003830321