Stem definition | Drug id | CAS RN |
---|---|---|
3574 | 73384-60-8 |
Molecule | Description |
---|---|
Synonyms:
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None
Property | Value | Reference |
---|---|---|
Vd (Volume of distribution) | 0.62 L/kg | Lombardo F, Berellini G, Obach RS |
CL (Clearance) | 10 mL/min/kg | Lombardo F, Berellini G, Obach RS |
fu (Fraction unbound in plasma) | 0.41 % | Lombardo F, Berellini G, Obach RS |
t_half (Half-life) | 0.80 hours | Lombardo F, Berellini G, Obach RS |
Vd (Volume of distribution) | 1.67 L/kg | Lombardo F, Berellini G, Obach RS |
CL (Clearance) | 20.70 mL/min/kg | Lombardo F, Berellini G, Obach RS |
fu (Fraction unbound in plasma) | 0.48 % | Lombardo F, Berellini G, Obach RS |
t_half (Half-life) | 1.20 hours | Lombardo F, Berellini G, Obach RS |
S (Water solubility) | 1.25 mg/mL | Bocci G, Oprea TI, Benet LZ |
BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Bocci G, Oprea TI, Benet LZ |
None
None
None
None
None
Source | Code | Description |
---|---|---|
MeSH PA | D002316 | Cardiotonic Agents |
MeSH PA | D002317 | Cardiovascular Agents |
MeSH PA | D004791 | Enzyme Inhibitors |
MeSH PA | D010726 | Phosphodiesterase Inhibitors |
MeSH PA | D020011 | Protective Agents |
CHEBI has role | CHEBI:38147 | cardiotonic drugs |
CHEBI has role | CHEBI:50218 | phosphodiesterase inhibitors |
CHEBI has role | CHEBI:63957 | adenosine A1 receptor antagonists |
None
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 11.72 | acidic |
pKa2 | 4.6 | Basic |
pKa3 | 1.29 | Basic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
cGMP-specific 3',5'-cyclic phosphodiesterase | Enzyme | IC50 | 4.68 | CHEMBL | |||||
Phosphodiesterase 3 | Enzyme | IC50 | 4.30 | CHEMBL |
ID | Source |
---|---|
86315-52-8 | SECONDARY_CAS_RN |
C0075619 | UMLSCUI |
CHEBI:34988 | CHEBI |
CHEMBL286020 | ChEMBL_ID |
CHEMBL2110680 | ChEMBL_ID |
C029758 | MESH_SUPPLEMENTAL_RECORD_UI |
5353 | PUBCHEM_CID |
4925 | INN_ID |
HK56EH9K44 | UNII |
5839 | INN_ID |
None