| Stem definition | Drug id | CAS RN |
|---|---|---|
| class III antiarrhythmics | 274 | 149908-53-2 |
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| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Hosey CM, Chan R, Benet LZ |
| Vd (Volume of distribution) | 13 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 2.40 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.06 % | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 79 hours | Lombardo F, Berellini G, Obach RS |
| S (Water solubility) | 290 mg/mL | Bocci G, Oprea TI, Benet LZ |
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| Source | Code | Description |
|---|---|---|
| MeSH PA | D000889 | Anti-Arrhythmia Agents |
| MeSH PA | D002121 | Calcium Channel Blockers |
| MeSH PA | D000077264 | Calcium-Regulating Hormones and Agents |
| MeSH PA | D002317 | Cardiovascular Agents |
| MeSH PA | D049990 | Membrane Transport Modulators |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 8.74 | Basic |
| pKa2 | 4.74 | Basic |
| pKa3 | 0.93 | Basic |
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily H member 2 | Ion channel | IC50 | 6.40 | CHEMBL | |||||
| Potassium voltage-gated channel subfamily H member 2 | Ion channel | IC50 | 6.74 | CHEMBL | |||||
| Potassium voltage-gated channel subfamily KQT member 1 | Ion channel | IC50 | 6.62 | CHEMBL | |||||
| Potassium voltage-gated channel subfamily KQT member 1 | Ion channel | BLOCKER | IC50 | 5.30 | IUPHAR |
| ID | Source |
|---|---|
| D03037 | KEGG_DRUG |
| 149888-94-8 | SECONDARY_CAS_RN |
| C0252416 | UMLSCUI |
| CHEBI:34545 | CHEBI |
| CHEMBL123558 | ChEMBL_ID |
| CHEMBL3140370 | ChEMBL_ID |
| CHEMBL537847 | ChEMBL_ID |
| DB04957 | DRUGBANK_ID |
| C086123 | MESH_SUPPLEMENTAL_RECORD_UI |
| 2588 | IUPHAR_LIGAND_ID |
| 7299 | INN_ID |
| 74QU6P2934 | UNII |
| 9571003 | PUBCHEM_CID |
None