Molecule Details
| InChIKey | HDAMOICMOAXFLJ-UHFFFAOYSA-N |
|---|---|
| Compound Name | Methylbenactyzium |
| Canonical SMILES | CC[N+](C)(CC)CCOC(=O)C(O)(c1ccccc1)c1ccccc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.46 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB13181 |
|---|---|
| Drug Name | Methylbenactyzium |
| CAS Number | 13473-61-5 |
| Groups | experimental |
| ATC Codes | nan |
| Description | nan |
Categories: Amines Ammonium Compounds Nitrogen Compounds Onium Compounds
Cross-references: CHEMBL1996652 ChemSpider: 3991 PubChem:4134 PubChem:347829283 ZINC: ZINC000001718373
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P08172 | CHRM2 | Homo sapiens | Human | PF00001 | 8.8 | Ki | ChEMBL;BindingDB |
| P11229 | CHRM1 | Homo sapiens | Human | PF00001 | 8.8 | Ki | ChEMBL;BindingDB |
| P20309 | CHRM3 | Homo sapiens | Human | PF00001 | 8.4 | Ki | ChEMBL;BindingDB |
| P08173 | CHRM4 | Homo sapiens | Human | PF00001 | 7.9 | Ki | ChEMBL;BindingDB |