| Stem definition | Drug id | CAS RN |
|---|---|---|
| vasodilators | 422 | 55837-25-7 |
| Molecule | Description |
|---|---|
|
Synonyms:
|
|
| Dose | Unit | Route |
|---|---|---|
| 0.60 | g | O |
| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Benet LZ, Broccatelli F, Oprea TI |
| EoM (Fraction excreted unchanged in urine) | 23.60 % | Benet LZ, Broccatelli F, Oprea TI |
| MRTD (Maximum Recommended Therapeutic Daily Dose) | 28.88 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
| BA (Bioavailability) | 65 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| Vd (Volume of distribution) | 1.30 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 5.60 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.40 % | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 3.30 hours | Lombardo F, Berellini G, Obach RS |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Jan. 1, 1976 | YEAR INTRODUCED |
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | C04AX20 | CARDIOVASCULAR SYSTEM PERIPHERAL VASODILATORS PERIPHERAL VASODILATORS Other peripheral vasodilators |
| MeSH PA | D002317 | Cardiovascular Agents |
| MeSH PA | D014665 | Vasodilator Agents |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.31 | Basic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Alpha-2A adrenergic receptor | GPCR | WOMBAT-PK | |||||||
| Sigma non-opioid intracellular receptor 1 | Membrane receptor | Ki | 5.89 | CHEMBL | |||||
| 3-beta-hydroxysteroid-Delta(8),Delta(7)-isomerase | Enzyme | Ki | 7.22 | CHEMBL | |||||
| Alpha-1A adrenergic receptor | GPCR | WOMBAT-PK | |||||||
| Alpha-2C adrenergic receptor | GPCR | WOMBAT-PK | |||||||
| Alpha-1D adrenergic receptor | GPCR | WOMBAT-PK | |||||||
| Alpha-1B adrenergic receptor | GPCR | WOMBAT-PK | |||||||
| Voltage-dependent calcium channel gamma-1 subunit | Ion channel | WOMBAT-PK | |||||||
| C-8 sterol isomerase | Enzyme | Ki | 5.15 | CHEMBL |
| ID | Source |
|---|---|
| D07176 | KEGG_DRUG |
| 35543-24-9 | SECONDARY_CAS_RN |
| 19836 | RXNORM |
| C0054207 | UMLSCUI |
| CHEBI:94538 | CHEBI |
| CHEMBL188921 | ChEMBL_ID |
| DB13510 | DRUGBANK_ID |
| C010651 | MESH_SUPPLEMENTAL_RECORD_UI |
| 2467 | PUBCHEM_CID |
| 3735 | INN_ID |
| V7I71DQ432 | UNII |
| 703405005 | SNOMEDCT_US |
| 004291 | NDDF |
| 004292 | NDDF |
None