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