Stem definition | Drug id | CAS RN |
---|---|---|
beta-adrenoreceptor antagonists | 360 | 59170-23-9 |
Dose | Unit | Route |
---|---|---|
0.30 | g | O |
Property | Value | Reference |
---|---|---|
BDDCS (Biopharmaceutical Drug Disposition Classification System) | 2 | Benet LZ, Broccatelli F, Oprea TI |
S (Water solubility) | 0.18 mg/mL | Benet LZ, Broccatelli F, Oprea TI |
EoM (Fraction excreted unchanged in urine) | 8 % | Benet LZ, Broccatelli F, Oprea TI |
BA (Bioavailability) | 57 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
Vd (Volume of distribution) | 0.67 L/kg | Lombardo F, Berellini G, Obach RS |
CL (Clearance) | 5.50 mL/min/kg | Lombardo F, Berellini G, Obach RS |
fu (Fraction unbound in plasma) | 0.02 % | Lombardo F, Berellini G, Obach RS |
t_half (Half-life) | 1.90 hours | Lombardo F, Berellini G, Obach RS |
Date | Agency | Company | Orphan |
---|---|---|---|
Jan. 1, 1987 | YEAR INTRODUCED |
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Source | Code | Description |
---|---|---|
ATC | C07AB06 | CARDIOVASCULAR SYSTEM BETA BLOCKING AGENTS BETA BLOCKING AGENTS Beta blocking agents, selective |
ATC | C07BB06 | CARDIOVASCULAR SYSTEM BETA BLOCKING AGENTS BETA BLOCKING AGENTS AND THIAZIDES Beta blocking agents, selective, and thiazides |
MeSH PA | D018663 | Adrenergic Agents |
MeSH PA | D018674 | Adrenergic Antagonists |
MeSH PA | D058671 | Adrenergic beta-1 Receptor Antagonists |
MeSH PA | D000319 | Adrenergic beta-Antagonists |
MeSH PA | D018377 | Neurotransmitter Agents |
CHEBI has role | CHEBI:35530 | beta-adrenergic blockers |
CHEBI has role | CHEBI:35674 | antihypertensive drugs |
CHEBI has role | CHEBI:38070 | antiarrhythmic agent |
CHEBI has role | CHEBI:38215 | calcium channel blockers |
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Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 8.28 | Basic |
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Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Beta-1 adrenergic receptor | GPCR | ANTAGONIST | WOMBAT-PK | SCIENTIFIC LITERATURE |
ID | Source |
---|---|
D01369 | KEGG_DRUG |
C0053532 | UMLSCUI |
CHEBI:238698 | CHEBI |
CHEMBL314010 | ChEMBL_ID |
CHEMBL2106060 | ChEMBL_ID |
DB01295 | DRUGBANK_ID |
C021148 | MESH_SUPPLEMENTAL_RECORD_UI |
2372 | PUBCHEM_CID |
4115 | INN_ID |
42864-78-8 | SECONDARY_CAS_RN |
34ZXW6ZV21 | UNII |
008146 | NDDF |
008147 | NDDF |
None